Thiocyanic Acid (2-benzothiazolylthio)methyl Ester

(2-Benzothiazolylthio)methyl thiocyanate
2-(Thiocyanatomethylthio)-1,3-benzothiazole
2-(Thiocyanatomethylthio)benzo[d]thiazole
2-(Thiocyanomethylthio)benzothiazole
2-(Thiocyanomethylthio)benzthiazole
2-[(Thiocyanatomethyl)thio]benzothiazole
Acticide WB 300
Afrotin CRO
Alentisan
Argent 30
Ascend (fufungicide)
Benthiazole
Busan 15
Busan 30
Busan 30-1
Busan 30A
Busan 30I
Busan 30L
Busan 30WB
Busan 30WBA
Busan 70
Busan 71
Busan 72
Busan 72A
Busan 80
Delsan 30
Fungicide FDE
Guzafan
Ichiban
KVK 733059
Nu-flow T
Nusan
Sancelant TMB
Superdavloxan
TCMTB
Thiocyanic acid, (2-benzothiazolylthio)methyl ester

Property	Value
InChI2D key string chemrof:inchi2d_key_string	TUBQDCKAWGHZPF-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C9H6N2S3/c10-5-12-6-13-9-11-7-3-1-2-4-8(7)14-9/h1-4H,6H2
IUPAC name chemrof:IUPAC_name	Thiocyanic Acid (2-benzothiazolylthio)methyl Ester
Molecular formula chemrof:molecular_formula	C9H6N2S3
Molecular mass chemrof:molecular_mass	238.362
Monoisotopic mass chemrof:monoisotopic_mass	237.969311
SMILES string chemrof:smiles_string	N#CSCSc1nc2ccccc2s1

Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.

Resource	URL	Recorded by
CAS Common Chemistry	https://commonchemistry.cas.org/detail?cas_rn=21564-17-0	enrich_references.consensus_cas_link
chem.echa.europa.eu	https://chem.echa.europa.eu/100.040.390	enrich_references.pubchem_identifier_url
chemicalsafety.ilo.org	https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=1161	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID6032647	enrich_references.pubchem_identifier_url
ebi.ac.uk	https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1903976	enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/5GE166YVQV	enrich_references.pubchem_identifier_url
HMDB	https://hmdb.ca/metabolites/HMDB0245617	enrich_references.pubchem_identifier_url
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J10.910J	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/30692	enrich_references.pubchem_compound
Wikidata	https://www.wikidata.org/wiki/Q158532	enrich_references.pubchem_identifier_url
Wikipedia	https://en.wikipedia.org/wiki/TCMTB	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
3e4cb44f-6556-11dd-ad8b-0800200c9a66	Environmental → Air → Aircraft cruise height	EF 3.1	kg	2
4d9a8790-3ddd-11dd-9c44-0050c2490048	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	2
fd16ef22-12b4-4760-bdf8-6f79bcb4c924	Environmental → Air → Indoor	EF 3.1	kg	2
4d9a8790-3ddd-11dd-9c43-0050c2490048	Environmental → Air → Long-term	EF 3.1	kg	0
4d9a8790-3ddd-11dd-9c45-0050c2490048	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	2
4d9a8790-3ddd-11dd-9c42-0050c2490048	Environmental → Air → Unknown	EF 3.1	kg	2
4d9a8790-3ddd-11dd-9c40-0050c2490048	Environmental → Ground → Agricultural	EF 3.1	kg	2
4d9a8790-3ddd-11dd-9c49-0050c2490048	Environmental → Ground → Non-agricultural	EF 3.1	kg	2
61797f21c9bd7d62fc92a3d23cd65f4ebaee02e1	Environmental → Ground → Silvicultural	ecoinvent algorithm addition	kg	0
4d9a8790-3ddd-11dd-9c41-0050c2490048	Environmental → Ground → Unknown	EF 3.1	kg	2
4d9a8790-3ddd-11dd-9c47-0050c2490048	Environmental → Water → Long-term	EF 3.1	kg	0
4d9a8790-3ddd-11dd-9c4a-0050c2490048	Environmental → Water → Ocean	EF 3.1	kg	2
4d9a8790-3ddd-11dd-9c46-0050c2490048	Environmental → Water → Surface water	EF 3.1	kg	2
810fb5609cab39355e82d82897221fff1b6e473e	Environmental → Water → Unconfined aquifer	stepwise algorithm addition	kg	0
4d9a8790-3ddd-11dd-9c48-0050c2490048	Environmental → Water → Unknown	EF 3.1	kg	2

Everything that changed this substance (56 changes)

Open the changes page

Flow object JSON

{
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Thiocyanic Acid (2-benzothiazolylthio)methyl Ester

Identity

Structure

Alternative labels

Properties

Known URLs

Elementary flows

History

Full record

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