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Details

Stereochemistry ABSOLUTE
Molecular Formula C6H14ClNO.ClH
Molecular Weight 188.095
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-Chloro-3-[(1-methylethyl)amino]-2-propanol hydrochloride, (2S)-

SMILES

Cl.CC(C)NC[C@H](O)CCl

InChI

InChIKey=FJWXQQCKEVEHBJ-FYZOBXCZSA-N
InChI=1S/C6H14ClNO.ClH/c1-5(2)8-4-6(9)3-7;/h5-6,8-9H,3-4H2,1-2H3;1H/t6-;/m1./s1

HIDE SMILES / InChI

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

Molecular Formula C6H14ClNO
Molecular Weight 151.634
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:31:28 GMT 2023
Edited
by admin
on Sat Dec 16 19:31:28 GMT 2023
Record UNII
CRA95KV72F
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-Chloro-3-[(1-methylethyl)amino]-2-propanol hydrochloride, (2S)-
Systematic Name English
2-Propanol, 1-chloro-3-[(1-methylethyl)amino]-, hydrochloride, (S)-
Systematic Name English
Code System Code Type Description
PUBCHEM
166451456
Created by admin on Sat Dec 16 19:31:28 GMT 2023 , Edited by admin on Sat Dec 16 19:31:28 GMT 2023
PRIMARY
FDA UNII
CRA95KV72F
Created by admin on Sat Dec 16 19:31:28 GMT 2023 , Edited by admin on Sat Dec 16 19:31:28 GMT 2023
PRIMARY
CAS
36141-41-0
Created by admin on Sat Dec 16 19:31:28 GMT 2023 , Edited by admin on Sat Dec 16 19:31:28 GMT 2023
PRIMARY
Related Record Type Details
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