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Details

Stereochemistry MIXED
Molecular Formula C15H22ClNO
Molecular Weight 267.794
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ?-Amino-1-(4-chlorophenyl)-?-methylcyclobutanebutanol

SMILES

CC(CO)CC(N)C1(CCC1)C2=CC=C(Cl)C=C2

InChI

InChIKey=XHDVFYPZKKBQMD-UHFFFAOYSA-N
InChI=1S/C15H22ClNO/c1-11(10-18)9-14(17)15(7-2-8-15)12-3-5-13(16)6-4-12/h3-6,11,14,18H,2,7-10,17H2,1H3

HIDE SMILES / InChI

Molecular Formula C15H22ClNO
Molecular Weight 267.794
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 19:16:35 GMT 2025
Edited
by admin
on Wed Apr 02 19:16:35 GMT 2025
Record UNII
R7H7WEZ588
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
?-Amino-1-(4-chlorophenyl)-?-methylcyclobutanebutanol
Systematic Name English
Cyclobutanebutanol, ?-amino-1-(4-chlorophenyl)-?-methyl- (9CI, ACI)
Preferred Name English
Code System Code Type Description
PUBCHEM
10492080
Created by admin on Wed Apr 02 19:16:35 GMT 2025 , Edited by admin on Wed Apr 02 19:16:35 GMT 2025
PRIMARY
FDA UNII
R7H7WEZ588
Created by admin on Wed Apr 02 19:16:35 GMT 2025 , Edited by admin on Wed Apr 02 19:16:35 GMT 2025
PRIMARY
CAS
186521-83-5
Created by admin on Wed Apr 02 19:16:35 GMT 2025 , Edited by admin on Wed Apr 02 19:16:35 GMT 2025
PRIMARY
EPA CompTox
DTXSID401214355
Created by admin on Wed Apr 02 19:16:35 GMT 2025 , Edited by admin on Wed Apr 02 19:16:35 GMT 2025
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT