U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C19H21Cl2N3O.2ClH
Molecular Weight 451.217
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ICR-191 DIHYDROCHLORIDE

SMILES

Cl.Cl.COC1=CC=C2N=C3C=C(Cl)C=CC3=C(NCCCNCCCl)C2=C1

InChI

InChIKey=LMEMIKWTNPWYMI-UHFFFAOYSA-N
InChI=1S/C19H21Cl2N3O.2ClH/c1-25-14-4-6-17-16(12-14)19(23-9-2-8-22-10-7-20)15-5-3-13(21)11-18(15)24-17;;/h3-6,11-12,22H,2,7-10H2,1H3,(H,23,24);2*1H

HIDE SMILES / InChI

Molecular Formula C19H21Cl2N3O
Molecular Weight 378.296
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Frameshift mutations induced by the acridine mustard ICR-191 in embryos and in the adult gill and hepatopancreas of rpsL transgenic zebrafish.
2005 Oct 15
Patents
Substance Class Chemical
Created
by admin
on Sat Dec 16 09:44:18 GMT 2023
Edited
by admin
on Sat Dec 16 09:44:18 GMT 2023
Record UNII
9U6A4Q2BE4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ICR-191 DIHYDROCHLORIDE
Common Name English
ACRIDINE, 6-CHLORO-9-((3-((2-CHLOROETHYL)AMINO)PROPYL)AMINO)-2-METHOXY-, DIHYDROCHLORIDE
Systematic Name English
1,3-PROPANEDIAMINE, N1-(2-CHLOROETHYL)-N3-(6-CHLORO-2-METHOXY-9-ACRIDINYL)-, HYDROCHLORIDE (1:2)
Systematic Name English
NSC-169657
Code English
ACRIDINE MUTAGEN ICR 191
Common Name English
ICR-191
Common Name English
6-CHLORO-9-((3-((2-CHLOROETHYL)AMINO)PROPYL)AMINO)-2-METHOXYACRIDINE DIHYDROCHLORIDE
Systematic Name English
Code System Code Type Description
CAS
17070-45-0
Created by admin on Sat Dec 16 09:44:18 GMT 2023 , Edited by admin on Sat Dec 16 09:44:18 GMT 2023
PRIMARY
NSC
169657
Created by admin on Sat Dec 16 09:44:18 GMT 2023 , Edited by admin on Sat Dec 16 09:44:18 GMT 2023
PRIMARY
FDA UNII
9U6A4Q2BE4
Created by admin on Sat Dec 16 09:44:18 GMT 2023 , Edited by admin on Sat Dec 16 09:44:18 GMT 2023
PRIMARY
ECHA (EC/EINECS)
241-129-4
Created by admin on Sat Dec 16 09:44:18 GMT 2023 , Edited by admin on Sat Dec 16 09:44:18 GMT 2023
PRIMARY
CHEBI
132980
Created by admin on Sat Dec 16 09:44:18 GMT 2023 , Edited by admin on Sat Dec 16 09:44:18 GMT 2023
PRIMARY
CHEBI
132982
Created by admin on Sat Dec 16 09:44:18 GMT 2023 , Edited by admin on Sat Dec 16 09:44:18 GMT 2023
PRIMARY
PUBCHEM
28240
Created by admin on Sat Dec 16 09:44:19 GMT 2023 , Edited by admin on Sat Dec 16 09:44:19 GMT 2023
PRIMARY
EPA CompTox
DTXSID70937814
Created by admin on Sat Dec 16 09:44:18 GMT 2023 , Edited by admin on Sat Dec 16 09:44:18 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE