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89448-39-5

89448-39-5 | Bicyclo[2.1.1]hexan-2-ol, 2-(aminomethyl)-1-chloro-

CAS No: 89448-39-5 Catalog No: AG0044ER MDL No:

Product Description

Catalog Number:
AG0044ER
Chemical Name:
Bicyclo[2.1.1]hexan-2-ol, 2-(aminomethyl)-1-chloro-
CAS Number:
89448-39-5
Molecular Formula:
C7H12ClNO
Molecular Weight:
161.6293
IUPAC Name:
2-(aminomethyl)-1-chlorobicyclo[2.1.1]hexan-2-ol
InChI:
InChI=1S/C7H12ClNO/c8-6-1-5(2-6)3-7(6,10)4-9/h5,10H,1-4,9H2
InChI Key:
XKVLMKIPHGKBJV-UHFFFAOYSA-N
SMILES:
NCC1(O)CC2CC1(Cl)C2

Properties

Complexity:
167  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.061g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
161.629g/mol
Monoisotopic Mass:
161.061g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2  

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