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23261-56-5 | 2-Propenoic acid, 2-hydroxy-2-methylpropyl ester
CAS No: 23261-56-5 Catalog No: AG002MPR MDL No:MFCD28361438
Product Description
Catalog Number:
AG002MPR
Chemical Name:
2-Propenoic acid, 2-hydroxy-2-methylpropyl ester
CAS Number:
23261-56-5
Molecular Formula:
C7H12O3
Molecular Weight:
144.1684
MDL Number:
MFCD28361438
IUPAC Name:
(2-hydroxy-2-methylpropyl) prop-2-enoate
InChI:
InChI=1S/C7H12O3/c1-4-6(8)10-5-7(2,3)9/h4,9H,1,5H2,2-3H3
InChI Key:
HSEDDQGMZGGFHS-UHFFFAOYSA-N
SMILES:
C=CC(=O)OCC(O)(C)C
Properties
Complexity:
138
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
144.079g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
144.17g/mol
Monoisotopic Mass:
144.079g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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