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89007-04-5 | 2-Heptanone, 1-amino-, hydrochloride
CAS No: 89007-04-5 Catalog No: AG00461B MDL No:
Product Description
Catalog Number:
AG00461B
Chemical Name:
2-Heptanone, 1-amino-, hydrochloride
CAS Number:
89007-04-5
Molecular Formula:
C7H16ClNO
Molecular Weight:
165.6610
IUPAC Name:
1-aminoheptan-2-one;hydrochloride
InChI:
InChI=1S/C7H15NO.ClH/c1-2-3-4-5-7(9)6-8;/h2-6,8H2,1H3;1H
InChI Key:
QCIJCUWMGMTMNG-UHFFFAOYSA-N
SMILES:
CCCCCC(=O)CN.Cl
Properties
Complexity:
81
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.092g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
165.661g/mol
Monoisotopic Mass:
165.092g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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