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147228-35-1 | Hexanoic acid, 3-amino-5,5-dimethyl-, (R)- (9CI)
CAS No: 147228-35-1 Catalog No: AG001EQ8 MDL No:
Product Description
Catalog Number:
AG001EQ8
Chemical Name:
Hexanoic acid, 3-amino-5,5-dimethyl-, (R)- (9CI)
CAS Number:
147228-35-1
Molecular Formula:
C8H17NO2
Molecular Weight:
159.2261
IUPAC Name:
(3R)-3-amino-5,5-dimethylhexanoic acid;hydrochloride
InChI:
InChI=1S/C8H17NO2.ClH/c1-8(2,3)5-6(9)4-7(10)11;/h6H,4-5,9H2,1-3H3,(H,10,11);1H/t6-;/m0./s1
InChI Key:
YZJSMEBXCQXZGS-RGMNGODLSA-N
SMILES:
N[C@H](CC(C)(C)C)CC(=O)O
Properties
Complexity:
138
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
195.103g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
195.687g/mol
Monoisotopic Mass:
195.103g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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