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13725-01-4

13725-01-4 | Cyclohexanecarboxylic acid, 1-amino-2-methyl-

CAS No: 13725-01-4 Catalog No: AG001302 MDL No:MFCD01734664

Product Description

Catalog Number:
AG001302
Chemical Name:
Cyclohexanecarboxylic acid, 1-amino-2-methyl-
CAS Number:
13725-01-4
Molecular Formula:
C8H15NO2
Molecular Weight:
157.2102
MDL Number:
MFCD01734664
IUPAC Name:
1-amino-2-methylcyclohexane-1-carboxylic acid
InChI:
InChI=1S/C8H15NO2/c1-6-4-2-3-5-8(6,9)7(10)11/h6H,2-5,9H2,1H3,(H,10,11)
InChI Key:
CGJBDGZSTFAYRN-UHFFFAOYSA-N
SMILES:
CC1CCCCC1(N)C(=O)O
NSC Number:
39063

Properties

Complexity:
170  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.11g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
157.213g/mol
Monoisotopic Mass:
157.11g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.4  

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