Home Carboxys 1-amino-3,3-dimethylcyclohexane-1-carboxylic acid

1-amino-3,3-dimethylcyclohexane-1-carboxylic acid

CAS No.:
1342395-00-9
Catalog Number:
AG01B6K5
Molecular Formula:
C9H17NO2
Molecular Weight:
171.2368
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Product Description
Catalog Number:
AG01B6K5
Chemical Name:
1-amino-3,3-dimethylcyclohexane-1-carboxylic acid
CAS Number:
1342395-00-9
Molecular Formula:
C9H17NO2
Molecular Weight:
171.2368
MDL Number:
MFCD20328637
IUPAC Name:
1-amino-3,3-dimethylcyclohexane-1-carboxylic acid
InChI:
InChI=1S/C9H17NO2/c1-8(2)4-3-5-9(10,6-8)7(11)12/h3-6,10H2,1-2H3,(H,11,12)
InChI Key:
NNLUUBZIUUDZLR-UHFFFAOYSA-N
SMILES:
OC(=O)C1(N)CCCC(C1)(C)C
Properties
Complexity:
201  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.126g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
171.24g/mol
Monoisotopic Mass:
171.126g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-1  
Properties