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87298-34-8 | 2H-Azepin-2-one, hexahydro-3-(methylamino)-, (R)-
CAS No: 87298-34-8 Catalog No: AG004P0X MDL No:
Product Description
Catalog Number:
AG004P0X
Chemical Name:
2H-Azepin-2-one, hexahydro-3-(methylamino)-, (R)-
CAS Number:
87298-34-8
Molecular Formula:
C7H14N2O
Molecular Weight:
142.1989
IUPAC Name:
(3R)-3-(methylamino)azepan-2-one
InChI:
InChI=1S/C7H14N2O/c1-8-6-4-2-3-5-9-7(6)10/h6,8H,2-5H2,1H3,(H,9,10)/t6-/m1/s1
InChI Key:
DWDJOZZRBORZQE-ZCFIWIBFSA-N
SMILES:
CN[C@@H]1CCCCNC1=O
Properties
Complexity:
125
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
142.111g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
142.202g/mol
Monoisotopic Mass:
142.111g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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