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115152-68-6 | 2-Butanone, 3-[(2-hydroxy-1-methylpropylidene)amino]-
CAS No: 115152-68-6 Catalog No: AG000GBY MDL No:
Product Description
Catalog Number:
AG000GBY
Chemical Name:
2-Butanone, 3-[(2-hydroxy-1-methylpropylidene)amino]-
CAS Number:
115152-68-6
Molecular Formula:
C8H15NO2
Molecular Weight:
157.2102
IUPAC Name:
3-(3-hydroxybutan-2-ylideneamino)butan-2-one
InChI:
InChI=1S/C8H15NO2/c1-5(7(3)10)9-6(2)8(4)11/h5,8,11H,1-4H3
InChI Key:
WMZYZISESWKMQW-UHFFFAOYSA-N
SMILES:
CC(=O)C(N=C(C(O)C)C)C
Properties
Complexity:
175
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.11g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
157.213g/mol
Monoisotopic Mass:
157.11g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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