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Details

Stereochemistry ACHIRAL
Molecular Formula C7H16ClN2O3P
Molecular Weight 242.64
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-(2-CHLOROETHYL)-2-OXO-2-HYDROXY-1,3,6,2-OXADIAZAPHOSPHONANE

SMILES

OP1(=O)OCCCNCCN1CCCl

InChI

InChIKey=SIMWMEHPUXRDQD-UHFFFAOYSA-N
InChI=1S/C7H16ClN2O3P/c8-2-5-10-6-4-9-3-1-7-13-14(10,11)12/h9H,1-7H2,(H,11,12)

HIDE SMILES / InChI

Molecular Formula C7H16ClN2O3P
Molecular Weight 242.64
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 Thu Jul 06 16:27:11 UTC 2023
Edited
by admin
on Thu Jul 06 16:27:11 UTC 2023
Record UNII
782QH86XIH
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-(2-CHLOROETHYL)-2-OXO-2-HYDROXY-1,3,6,2-OXADIAZAPHOSPHONANE
Systematic Name English
1,3,6,2-OXADIAZAPHOSPHONINE, 3-(2-CHLOROETHYL)OCTAHYDRO-2-HYDROXY-, 2-OXIDE
Systematic Name English
CYCLOPHOSPHAMIDE RELATED COMPOUND B [USP-RS]
Common Name English
CYCLOPHOSPHAMIDE RELATED COMPOUND B [USP IMPURITY]
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID00166418
Created by admin on Thu Jul 06 16:27:11 UTC 2023 , Edited by admin on Thu Jul 06 16:27:11 UTC 2023
PRIMARY
CAS
158401-52-6
Created by admin on Thu Jul 06 16:27:11 UTC 2023 , Edited by admin on Thu Jul 06 16:27:11 UTC 2023
PRIMARY
RS_ITEM_NUM
1157024
Created by admin on Thu Jul 06 16:27:11 UTC 2023 , Edited by admin on Thu Jul 06 16:27:11 UTC 2023
PRIMARY
FDA UNII
782QH86XIH
Created by admin on Thu Jul 06 16:27:11 UTC 2023 , Edited by admin on Thu Jul 06 16:27:11 UTC 2023
PRIMARY
PUBCHEM
3074468
Created by admin on Thu Jul 06 16:27:11 UTC 2023 , Edited by admin on Thu Jul 06 16:27:11 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (TLC)
USP