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1158985-17-1 | 1-Heptanol, 3-amino-, (3S)-
CAS No: 1158985-17-1 Catalog No: AG000H1X MDL No:MFCD19207949
Product Description
Catalog Number:
AG000H1X
Chemical Name:
1-Heptanol, 3-amino-, (3S)-
CAS Number:
1158985-17-1
Molecular Formula:
C7H17NO
Molecular Weight:
131.2160
MDL Number:
MFCD19207949
IUPAC Name:
(3S)-3-aminoheptan-1-ol
InChI:
InChI=1S/C7H17NO/c1-2-3-4-7(8)5-6-9/h7,9H,2-6,8H2,1H3/t7-/m0/s1
InChI Key:
UUJMTRBDHSMCOA-ZETCQYMHSA-N
SMILES:
CCCC[C@@H](CCO)N
Properties
Complexity:
56.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
131.131g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
131.219g/mol
Monoisotopic Mass:
131.131g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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