Home Other Building Blocks 2,3-Butadienoic acid, methyl ester

2,3-Butadienoic acid, methyl ester

CAS No.:
18913-35-4
Catalog Number:
AG002HXR
Molecular Formula:
C5H6O2
Molecular Weight:
98.0999
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Product Description
Catalog Number:
AG002HXR
Chemical Name:
2,3-Butadienoic acid, methyl ester
CAS Number:
18913-35-4
Molecular Formula:
C5H6O2
Molecular Weight:
98.0999
MDL Number:
MFCD17013415
IUPAC Name:
methyl buta-2,3-dienoate
InChI:
InChI=1S/C5H6O2/c1-3-4-5(6)7-2/h4H,1H2,2H3
InChI Key:
CYKLAQPZTQQBJU-UHFFFAOYSA-N
SMILES:
COC(=O)C=C=C
Properties
Complexity:
109  
Compound Is Canonicalized:
No
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
98.037g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
98.101g/mol
Monoisotopic Mass:
98.037g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Properties