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951891-48-8 | 2-Bromo-3-(3,5-dimethoxyphenyl)-1-propene
CAS No: 951891-48-8 Catalog No: AG01EZY7 MDL No:
Product Description
Catalog Number:
AG01EZY7
Chemical Name:
2-Bromo-3-(3,5-dimethoxyphenyl)-1-propene
CAS Number:
951891-48-8
Molecular Formula:
C11H13BrO2
Molecular Weight:
257.1237
IUPAC Name:
1-(2-bromoprop-2-enyl)-3,5-dimethoxybenzene
InChI:
InChI=1S/C11H13BrO2/c1-8(12)4-9-5-10(13-2)7-11(6-9)14-3/h5-7H,1,4H2,2-3H3
InChI Key:
OBPQHJWRVPZABI-UHFFFAOYSA-N
SMILES:
COc1cc(CC(=C)Br)cc(c1)OC
Properties
Complexity:
182
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.01g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
257.127g/mol
Monoisotopic Mass:
256.01g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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