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Details

Stereochemistry ACHIRAL
Molecular Formula C9H16ClN3O2
Molecular Weight 233.695
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-(2-CHLOROETHYL)-1-CYCLOHEXYL-1-NITROSOUREA

SMILES

ClCCNC(=O)N(N=O)C1CCCCC1

InChI

InChIKey=IGMMTYZWNUSEEU-UHFFFAOYSA-N
InChI=1S/C9H16ClN3O2/c10-6-7-11-9(14)13(12-15)8-4-2-1-3-5-8/h8H,1-7H2,(H,11,14)

HIDE SMILES / InChI

Molecular Formula C9H16ClN3O2
Molecular Weight 233.695
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:33:04 GMT 2023
Edited
by admin
on Sat Dec 16 18:33:04 GMT 2023
Record UNII
3PU8X9N1UI
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-(2-CHLOROETHYL)-1-CYCLOHEXYL-1-NITROSOUREA
Systematic Name English
UREA, N'-(2-CHLOROETHYL)-N-CYCLOHEXYL-N-NITROSO-
Systematic Name English
LOMUSTINE RELATED COMPOUND D [USP IMPURITY]
Common Name English
ISOMUSTINE [USP IMPURITY]
Common Name English
LOMUSTINE RELATED COMPOUND D [USP-RS]
Common Name English
N'-(2-CHLOROETHYL)-N-CYCLOHEXYL-N-NITROSOUREA
Systematic Name English
Code System Code Type Description
FDA UNII
3PU8X9N1UI
Created by admin on Sat Dec 16 18:33:04 GMT 2023 , Edited by admin on Sat Dec 16 18:33:04 GMT 2023
PRIMARY
EPA CompTox
DTXSID30203209
Created by admin on Sat Dec 16 18:33:04 GMT 2023 , Edited by admin on Sat Dec 16 18:33:04 GMT 2023
PRIMARY
CAS
54749-91-6
Created by admin on Sat Dec 16 18:33:04 GMT 2023 , Edited by admin on Sat Dec 16 18:33:04 GMT 2023
PRIMARY
RS_ITEM_NUM
1369453
Created by admin on Sat Dec 16 18:33:04 GMT 2023 , Edited by admin on Sat Dec 16 18:33:04 GMT 2023
PRIMARY
PUBCHEM
3041706
Created by admin on Sat Dec 16 18:33:04 GMT 2023 , Edited by admin on Sat Dec 16 18:33:04 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP