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138298-94-9 | 2-Propenoic acid, 2-(propoxymethyl)-, methyl ester
CAS No: 138298-94-9 Catalog No: AG0018GZ MDL No:
Product Description
Catalog Number:
AG0018GZ
Chemical Name:
2-Propenoic acid, 2-(propoxymethyl)-, methyl ester
CAS Number:
138298-94-9
Molecular Formula:
C8H14O3
Molecular Weight:
158.1950
IUPAC Name:
methyl 2-(propoxymethyl)prop-2-enoate
InChI:
InChI=1S/C8H14O3/c1-4-5-11-6-7(2)8(9)10-3/h2,4-6H2,1,3H3
InChI Key:
OVZWLGCWEYISAY-UHFFFAOYSA-N
SMILES:
CCCOCC(=C)C(=O)OC
Properties
Complexity:
140
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.094g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
158.197g/mol
Monoisotopic Mass:
158.094g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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