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811867-45-5 | Phenol, 2-bromo-6-ethenyl-
CAS No: 811867-45-5 Catalog No: AG005FB7 MDL No:
Product Description
Catalog Number:
AG005FB7
Chemical Name:
Phenol, 2-bromo-6-ethenyl-
CAS Number:
811867-45-5
Molecular Formula:
C8H7BrO
Molecular Weight:
199.0446
IUPAC Name:
2-bromo-6-ethenylphenol
InChI:
InChI=1S/C8H7BrO/c1-2-6-4-3-5-7(9)8(6)10/h2-5,10H,1H2
InChI Key:
ITVXPWJVZSXFCC-UHFFFAOYSA-N
SMILES:
C=Cc1cccc(c1O)Br
Properties
Complexity:
124
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.968g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
199.047g/mol
Monoisotopic Mass:
197.968g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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