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84100-24-3 | 2-Butanone,O-[(ethenylamino)carbonyl]oxime (9CI)
CAS No: 84100-24-3 Catalog No: AG004ST7 MDL No:
Product Description
Catalog Number:
AG004ST7
Chemical Name:
2-Butanone,O-[(ethenylamino)carbonyl]oxime (9CI)
CAS Number:
84100-24-3
Molecular Formula:
C7H12N2O2
Molecular Weight:
156.1824
IUPAC Name:
[(Z)-butan-2-ylideneamino] N-ethenylcarbamate
InChI:
InChI=1S/C7H12N2O2/c1-4-6(3)9-11-7(10)8-5-2/h5H,2,4H2,1,3H3,(H,8,10)/b9-6-
InChI Key:
LMYJMOOCCAZUDF-TWGQIWQCSA-N
SMILES:
CC(=NOC(=O)NC=C)CC
EC Number:
282-105-3
Properties
Complexity:
175
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
156.09g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
156.185g/mol
Monoisotopic Mass:
156.09g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
50.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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