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1246471-46-4 | 1-Butanone, 3-amino-3-methyl-1-(1-pyrrolidinyl)-, hydrochloride (1:1)
CAS No: 1246471-46-4 Catalog No: AG000MIK MDL No:MFCD17171367
Product Description
Catalog Number:
AG000MIK
Chemical Name:
1-Butanone, 3-amino-3-methyl-1-(1-pyrrolidinyl)-, hydrochloride (1:1)
CAS Number:
1246471-46-4
Molecular Formula:
C9H19ClN2O
Molecular Weight:
206.7130
MDL Number:
MFCD17171367
IUPAC Name:
3-amino-3-methyl-1-pyrrolidin-1-ylbutan-1-one;hydrochloride
InChI:
InChI=1S/C9H18N2O.ClH/c1-9(2,10)7-8(12)11-5-3-4-6-11;/h3-7,10H2,1-2H3;1H
InChI Key:
LUYDDQWQWVQIEN-UHFFFAOYSA-N
SMILES:
O=C(N1CCCC1)CC(N)(C)C.Cl
Properties
Complexity:
171
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.119g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
206.714g/mol
Monoisotopic Mass:
206.119g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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