Home Other Building Blocks 2-fluorobut-2-enoic acid

2-fluorobut-2-enoic acid

CAS No.:
383-85-7
Catalog Number:
AG01C3JZ
Molecular Formula:
C4H5FO2
Molecular Weight:
104.0797
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Product Description
Catalog Number:
AG01C3JZ
Chemical Name:
2-fluorobut-2-enoic acid
CAS Number:
383-85-7
Molecular Formula:
C4H5FO2
Molecular Weight:
104.0797
MDL Number:
MFCD23703556
IUPAC Name:
2-fluorobut-2-enoic acid
InChI:
InChI=1S/C4H5FO2/c1-2-3(5)4(6)7/h2H,1H3,(H,6,7)
InChI Key:
LWCDSJZGNUDNCO-UHFFFAOYSA-N
SMILES:
CC=C(C(=O)O)F
Properties
Complexity:
106  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
104.027g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
104.08g/mol
Monoisotopic Mass:
104.027g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
0.9  
Properties