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14903-90-3 | 2-Furancarboxylic acid, 3-bromo-
CAS No: 14903-90-3 Catalog No: AG001LD0 MDL No:MFCD00092761
Product Description
Catalog Number:
AG001LD0
Chemical Name:
2-Furancarboxylic acid, 3-bromo-
CAS Number:
14903-90-3
Molecular Formula:
C5H3BrO3
Molecular Weight:
190.9795
MDL Number:
MFCD00092761
IUPAC Name:
3-bromofuran-2-carboxylic acid
InChI:
InChI=1S/C5H3BrO3/c6-3-1-2-9-4(3)5(7)8/h1-2H,(H,7,8)
InChI Key:
UZBGSJZFBUOJNE-UHFFFAOYSA-N
SMILES:
OC(=O)c1occc1Br
Properties
Complexity:
125
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.927g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
190.98g/mol
Monoisotopic Mass:
189.927g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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