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1009-80-9 | 2-Propenoic acid, 3-(4-morpholinyl)-, methyl ester
CAS No: 1009-80-9 Catalog No: AG00034I MDL No:
Product Description
Catalog Number:
AG00034I
Chemical Name:
2-Propenoic acid, 3-(4-morpholinyl)-, methyl ester
CAS Number:
1009-80-9
Molecular Formula:
C8H13NO3
Molecular Weight:
171.1937
IUPAC Name:
methyl 3-morpholin-4-ylprop-2-enoate
InChI:
InChI=1S/C8H13NO3/c1-11-8(10)2-3-9-4-6-12-7-5-9/h2-3H,4-7H2,1H3
InChI Key:
XFGDIQBAFODGRV-UHFFFAOYSA-N
SMILES:
COC(=O)C=CN1CCOCC1
Properties
Complexity:
173
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.09g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
171.196g/mol
Monoisotopic Mass:
171.09g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
38.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
0.1
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