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13325-11-6 | 3-Hexanol, 2-amino-
CAS No: 13325-11-6 Catalog No: AG0014H2 MDL No:
Product Description
Catalog Number:
AG0014H2
Chemical Name:
3-Hexanol, 2-amino-
CAS Number:
13325-11-6
Molecular Formula:
C6H15NO
Molecular Weight:
117.1894
IUPAC Name:
2-aminohexan-3-ol
InChI:
InChI=1S/C6H15NO/c1-3-4-6(8)5(2)7/h5-6,8H,3-4,7H2,1-2H3
InChI Key:
TXRCHGMTTXKTPE-UHFFFAOYSA-N
SMILES:
CCCC(C(N)C)O
NSC Number:
17699
Properties
Complexity:
56.5
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
117.115g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
117.192g/mol
Monoisotopic Mass:
117.115g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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