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Details

Stereochemistry RACEMIC
Molecular Formula 2C6H13N.C3H8ClO5P
Molecular Weight 388.868
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of .ALPHA.-CHLOROHYDRIN-1-PHOSPHATE BISCYCLOHEXYLAMINE

SMILES

NC1CCCCC1.NC2CCCCC2.OC(CCl)COP(O)(O)=O

InChI

InChIKey=HYFCADSYJBHWDU-UHFFFAOYSA-N
InChI=1S/2C6H13N.C3H8ClO5P/c2*7-6-4-2-1-3-5-6;4-1-3(5)2-9-10(6,7)8/h2*6H,1-5,7H2;3,5H,1-2H2,(H2,6,7,8)

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
.ALPHA.-CHLOROHYDRIN-1-PHOSPHATE BISCYCLOHEXYLAMINE
Common Name English
ALPHA-CHLOROHYDRIN 1-PHOSPHATE, BISCYCLOHEXYLAMINE SALT
Common Name English
1,2-PROPANEDIOL, 3-CHLORO-, 1-(DIHYDROGEN PHOSPHATE), COMPD. WITH CYCLOHEXYLAMINE (1:2), DL-
Systematic Name English
Code System Code Type Description
PUBCHEM
208039
Created by admin on Sat Dec 16 08:01:21 GMT 2023 , Edited by admin on Sat Dec 16 08:01:21 GMT 2023
PRIMARY
CAS
31537-45-8
Created by admin on Sat Dec 16 08:01:21 GMT 2023 , Edited by admin on Sat Dec 16 08:01:21 GMT 2023
PRIMARY
EPA CompTox
DTXSID90953516
Created by admin on Sat Dec 16 08:01:21 GMT 2023 , Edited by admin on Sat Dec 16 08:01:21 GMT 2023
PRIMARY
FDA UNII
OJ5L5432Y9
Created by admin on Sat Dec 16 08:01:21 GMT 2023 , Edited by admin on Sat Dec 16 08:01:21 GMT 2023
PRIMARY
NIH
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