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125376-15-0 | 5(4H)-Oxazolone, 4,4-dimethyl-2-(1-propen-1-yl)-
CAS No: 125376-15-0 Catalog No: AG000NK7 MDL No:MFCD11977240
Product Description
Catalog Number:
AG000NK7
Chemical Name:
5(4H)-Oxazolone, 4,4-dimethyl-2-(1-propen-1-yl)-
CAS Number:
125376-15-0
Molecular Formula:
C8H11NO2
Molecular Weight:
153.1784
MDL Number:
MFCD11977240
IUPAC Name:
4,4-dimethyl-2-prop-1-enyl-1,3-oxazol-5-one
InChI:
InChI=1S/C8H11NO2/c1-4-5-6-9-8(2,3)7(10)11-6/h4-5H,1-3H3
InChI Key:
FBXDMYKUMYUYHT-UHFFFAOYSA-N
SMILES:
CC=CC1=NC(C(=O)O1)(C)C
Properties
Complexity:
239
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
153.079g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
153.181g/mol
Monoisotopic Mass:
153.079g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.2
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