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2761-09-3 | 2-Propenoic acid, 2-methyl-, 3-hydroxypropyl ester
CAS No: 2761-09-3 Catalog No: AG002U83 MDL No:MFCD00051317
Product Description
Catalog Number:
AG002U83
Chemical Name:
2-Propenoic acid, 2-methyl-, 3-hydroxypropyl ester
CAS Number:
2761-09-3
Molecular Formula:
C7H12O3
Molecular Weight:
144.1684
MDL Number:
MFCD00051317
IUPAC Name:
3-hydroxypropyl 2-methylprop-2-enoate
InChI:
InChI=1S/C7H12O3/c1-6(2)7(9)10-5-3-4-8/h8H,1,3-5H2,2H3
InChI Key:
GNSFRPWPOGYVLO-UHFFFAOYSA-N
SMILES:
CC(=C)C(=O)OCCCO
EC Number:
220-426-2
UNII:
523A6318HJ
Properties
Complexity:
129
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:
5
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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