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p-(tert-Butyl)benzamide
| Flow Object ID | fo-7b4e80caa4d943d3 | ||||||
|---|---|---|---|---|---|---|---|
| Type | Consensus | ||||||
| prefLabel |
|
||||||
| Alt Labels |
|
||||||
| CAS Numbers | 56108-12-4 | ||||||
| EC Numbers | 666-866-2 | ||||||
| Changes Applied | 13 |
Properties
| Predicate | Value |
|---|---|
| InChIKey |
VIPMBJSGYWWHAO-UHFFFAOYSA-N
|
| InChI |
InChI=1S/C11H15NO/c1-11(2,3)9-6-4-8(5-7-9)10(12)13/h4-7H,1-3H3,(H2,12,13)
|
| IUPAC name |
4-tert-butylbenzamide
|
| Molecular formula |
C11H15NO
|
| SMILES |
CC(C)(C)C1=CC=C(C=C1)C(=O)N
|
References
- http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J267.360F
- https://chem.echa.europa.eu/100.192.897
- https://commonchemistry.cas.org/detail?cas_rn=56108-12-4
- https://comptox.epa.gov/dashboard/DTXSID3022295
- https://gsrs.ncats.nih.gov/ginas/app/beta/substances/5E7907Z6BM
- https://pubchem.ncbi.nlm.nih.gov/compound/92014
- https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL2426225
- https://www.wikidata.org/wiki/Q27893868
Linked Elementary Flows
| UUID | Source | Unit | Context | LCIA Factors | Consensus Changes |
|---|---|---|---|---|---|
2461252b… |
EF 3.1 | kg | Environmental → Air → Aircraft cruise height | 2 | 1 |
be34ef5f… |
EF 3.1 | kg | Environmental → Air → Ground level → Rural (<1000 people/square mile) | 0 | 1 |
126f462b… |
EF 3.1 | kg | Environmental → Air → Ground level → Urban (>1000 people/square mile) | 2 | 1 |
d699d693… |
EF 3.1 | kg | Environmental → Air → High stack, >150 meters | 2 | 1 |
ce82fdb2… |
EF 3.1 | kg | Environmental → Air → Unknown | 2 | 1 |
f21cc509… |
EF 3.1 | kg | Environmental → Air → Unknown | 2 | 1 |
a5251b66… |
EF 3.1 | kg | Environmental → Ground → Agricultural | 2 | 1 |
60184035… |
EF 3.1 | kg | Environmental → Ground → Unknown | 2 | 1 |
14eec796… |
EF 3.1 | kg | Environmental → Water → Ocean | 2 | 1 |
677bf779… |
EF 3.1 | kg | Environmental → Water → Surface water | 2 | 1 |
d2fcd23c… |
EF 3.1 | kg | Environmental → Water → Unknown | 2 | 1 |
▶
Changes Applied
| Elementary Flow | Field | Old Value | New Value | Comment |
|---|---|---|---|---|
0643ab57… |
cas_match_labels |
— |
{"56108-12-4":"exactMatch"} |
group_key=4-tert-butylbenzamide||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['pubchem']; cas_sources={'56108-12-4': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7b4e80caa4d943d3: {'56108-12-4': 'exactMatch'} |
126f462b… |
cas_match_labels |
— |
{"56108-12-4":"exactMatch"} |
group_key=4-tert-butylbenzamide||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['pubchem']; cas_sources={'56108-12-4': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7b4e80caa4d943d3: {'56108-12-4': 'exactMatch'} |
14eec796… |
cas_match_labels |
— |
{"56108-12-4":"exactMatch"} |
group_key=4-tert-butylbenzamide||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['pubchem']; cas_sources={'56108-12-4': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7b4e80caa4d943d3: {'56108-12-4': 'exactMatch'} |
2461252b… |
cas_match_labels |
— |
{"56108-12-4":"exactMatch"} |
group_key=4-tert-butylbenzamide||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['pubchem']; cas_sources={'56108-12-4': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7b4e80caa4d943d3: {'56108-12-4': 'exactMatch'} |
60184035… |
cas_match_labels |
— |
{"56108-12-4":"exactMatch"} |
group_key=4-tert-butylbenzamide||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['pubchem']; cas_sources={'56108-12-4': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7b4e80caa4d943d3: {'56108-12-4': 'exactMatch'} |
677bf779… |
cas_match_labels |
— |
{"56108-12-4":"exactMatch"} |
group_key=4-tert-butylbenzamide||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['pubchem']; cas_sources={'56108-12-4': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7b4e80caa4d943d3: {'56108-12-4': 'exactMatch'} |
a5251b66… |
cas_match_labels |
— |
{"56108-12-4":"exactMatch"} |
group_key=4-tert-butylbenzamide||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['pubchem']; cas_sources={'56108-12-4': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7b4e80caa4d943d3: {'56108-12-4': 'exactMatch'} |
be34ef5f… |
cas_match_labels |
— |
{"56108-12-4":"exactMatch"} |
group_key=4-tert-butylbenzamide||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['pubchem']; cas_sources={'56108-12-4': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7b4e80caa4d943d3: {'56108-12-4': 'exactMatch'} |
c1fc72a4… |
cas_match_labels |
— |
{"56108-12-4":"exactMatch"} |
group_key=4-tert-butylbenzamide||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['pubchem']; cas_sources={'56108-12-4': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7b4e80caa4d943d3: {'56108-12-4': 'exactMatch'} |
ce82fdb2… |
cas_match_labels |
— |
{"56108-12-4":"exactMatch"} |
group_key=4-tert-butylbenzamide||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['pubchem']; cas_sources={'56108-12-4': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7b4e80caa4d943d3: {'56108-12-4': 'exactMatch'} |
d2fcd23c… |
cas_match_labels |
— |
{"56108-12-4":"exactMatch"} |
group_key=4-tert-butylbenzamide||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['pubchem']; cas_sources={'56108-12-4': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7b4e80caa4d943d3: {'56108-12-4': 'exactMatch'} |
d699d693… |
cas_match_labels |
— |
{"56108-12-4":"exactMatch"} |
group_key=4-tert-butylbenzamide||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['pubchem']; cas_sources={'56108-12-4': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7b4e80caa4d943d3: {'56108-12-4': 'exactMatch'} |
f21cc509… |
cas_match_labels |
— |
{"56108-12-4":"exactMatch"} |
group_key=4-tert-butylbenzamide||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['pubchem']; cas_sources={'56108-12-4': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7b4e80caa4d943d3: {'56108-12-4': 'exactMatch'} |
Flow Object JSON
{
"flow_object_id": "fo-7b4e80caa4d943d3",
"prefLabel": [
{
"@value": "p-(tert-Butyl)benzamide",
"@language": "en",
"@lang": "en",
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],
"prov:wasDerivedFrom": "prefLabel"
}
}
],
"altLabel": [
{
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],
"properties": {
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},
"https://w3id.org/chemrof/inchi2d_key_string": {
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},
"https://w3id.org/chemrof/smiles_string": {
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"rdfs:label": "SMILES",
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},
"https://w3id.org/chemrof/inchi2d_string": {
"@id": "https://w3id.org/chemrof/inchi2d_string",
"@value": [
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],
"rdfs:label": "InChI",
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},
"https://w3id.org/chemrof/IUPAC_name": {
"@id": "https://w3id.org/chemrof/IUPAC_name",
"@value": [
"4-tert-butylbenzamide"
],
"rdfs:label": "IUPAC name",
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"created_from": {
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"seed_uuid": "0643ab57-6e1b-4acc-afa3-0e06512360da",
"seed_source": "EF 3.1"
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"origin_qualifier": null,
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}