1,1'-isophthaloylbiscaprolactam

1,1′-(1,3-Phenylenedicarbonyl)bis[hexahydro-2H-azepin-2-one]
1,1′-[1,3-Phenylenedi(carbonyl)]diazepan-2-one
1,1′-isophthaloylbis(azepan-2-one)
1,1′-Isophthaloylbiscaprolactam
1-[3-(2-Oxoazepane-1-carbonyl)benzoyl]azepan-2-one
2H-Azepin-2-one, 1,1′-(1,3-phenylenedicarbonyl)bis[hexahydro-
2H-Azepin-2-one, 1,1′-isophthaloylbis[hexahydro-
Isophthaloyl-bis-ε-caprolactam
Isophthaloylbis(N-caprolactam)
Isophthaloylbiscaprolactam
N,N′-Isophthaloylbis(caprolactam)
N,N′-Isophthaloylbis(ε-caprolactam)
N,N′-Isophthaloyldicaprolactam

Property	Value
InChI2D key string chemrof:inchi2d_key_string	HXZRLUTUNSQNCG-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C20H24N2O4/c23-17-10-3-1-5-12-21(17)19(25)15-8-7-9-16(14-15)20(26)22-13-6-2-4-11-18(22)24/h7-9,14H,1-6,10-13H2
IUPAC name chemrof:IUPAC_name	1,1′-(1,3-Phenylenedicarbonyl)bis[hexahydro-2H-azepin-2-one]
Molecular formula chemrof:molecular_formula	C20H24N2O4
Molecular mass chemrof:molecular_mass	356.422
Monoisotopic mass chemrof:monoisotopic_mass	356.173607
SMILES string chemrof:smiles_string	O=C1CCCCCN1C(=O)c1cccc(C(=O)N2CCCCCC2=O)c1

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=7381-13-7	enrich_references.pubchem_identifier_url
chem.echa.europa.eu	https://chem.echa.europa.eu/100.133.324	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID60864049	enrich_references.pubchem_identifier_url
ebi.ac.uk	https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1875228	enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/8J2BLF2T65	enrich_references.pubchem_identifier_url
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J421.857D	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/81857	enrich_references.pubchem_compound
Wikidata	https://www.wikidata.org/wiki/Q72485506	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
22526f31-303b-4817-81d3-95c3df113efc	Environmental → Air → Aircraft cruise height	EF 3.1	kg	2
87849560-4a7b-4543-9640-0da88038e7f0	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	2
1a2f2d01-8f6d-44eb-819d-be9c194a15a6	Environmental → Air → Indoor	EF 3.1	kg	2
be1cfe81-ef5b-4feb-bb16-f31660c4e11a	Environmental → Air → Long-term	EF 3.1	kg	0
1df26384-497f-4d06-80d3-22730a4dc6e0	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	2
e00ed052-0135-407b-8fc6-6cf91058b0ca	Environmental → Air → Unknown	EF 3.1	kg	2
444a87db-944a-4102-8859-603edfe7473f	Environmental → Ground → Agricultural	EF 3.1	kg	2
11f2e91f-6dc1-4ad3-83c9-ad5723bf709a	Environmental → Ground → Non-agricultural	EF 3.1	kg	2
2387bf85-f32c-4fa9-a7bd-241c99f345b1	Environmental → Ground → Unknown	EF 3.1	kg	2
6b00084f-edfe-4f99-b172-be7755acaabb	Environmental → Water → Long-term	EF 3.1	kg	0
7e86b01e-883c-47a8-90af-f4b5aeabfbfc	Environmental → Water → Ocean	EF 3.1	kg	2
3d6aab18-c556-4657-ac9a-1d5713dde122	Environmental → Water → Surface water	EF 3.1	kg	2
bebe2c1b-fda3-423e-864a-9eb9e91a9119	Environmental → Water → Unknown	EF 3.1	kg	2

Everything that changed this substance (54 changes)

Open the changes page

Flow object JSON

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}

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1,1'-isophthaloylbiscaprolactam

Identity

Structure

Alternative labels

Properties

Known URLs

Elementary flows

History

Full record

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