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4519-46-4 | Methyl 2-bromoacrylate
CAS No: 4519-46-4 Catalog No: AG00359B MDL No:MFCD08276754
Product Description
Catalog Number:
AG00359B
Chemical Name:
Methyl 2-bromoacrylate
CAS Number:
4519-46-4
Molecular Formula:
C4H5BrO2
Molecular Weight:
164.9853
MDL Number:
MFCD08276754
IUPAC Name:
methyl 2-bromoprop-2-enoate
InChI:
InChI=1S/C4H5BrO2/c1-3(5)4(6)7-2/h1H2,2H3
InChI Key:
HVJXPDPGPORYKY-UHFFFAOYSA-N
SMILES:
COC(=O)C(=C)Br
NSC Number:
24144
Properties
Complexity:
97.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.947g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
164.986g/mol
Monoisotopic Mass:
163.947g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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