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842140-36-7 | 2-BROMO-3-(3,4-DIMETHOXYPHENYL)-1-PROPENE
CAS No: 842140-36-7 Catalog No: AG004OR4 MDL No:
Product Description
Catalog Number:
AG004OR4
Chemical Name:
2-BROMO-3-(3,4-DIMETHOXYPHENYL)-1-PROPENE
CAS Number:
842140-36-7
Molecular Formula:
C11H13BrO2
Molecular Weight:
257.1237
IUPAC Name:
4-(2-bromoprop-2-enyl)-1,2-dimethoxybenzene
InChI:
InChI=1S/C11H13BrO2/c1-8(12)6-9-4-5-10(13-2)11(7-9)14-3/h4-5,7H,1,6H2,2-3H3
InChI Key:
ZDPWCPRPNKEQLQ-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1OC)CC(=C)Br
Properties
Complexity:
194
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
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