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951893-91-7

951893-91-7 | 2-Bromo-3-(4-methoxy-2-methylphenyl)-1-propene

CAS No: 951893-91-7 Catalog No: AG01F03U MDL No:

Product Description

Catalog Number:
AG01F03U
Chemical Name:
2-Bromo-3-(4-methoxy-2-methylphenyl)-1-propene
CAS Number:
951893-91-7
Molecular Formula:
C11H13BrO
Molecular Weight:
241.1243
IUPAC Name:
1-(2-bromoprop-2-enyl)-4-methoxy-2-methylbenzene
InChI:
InChI=1S/C11H13BrO/c1-8-6-11(13-3)5-4-10(8)7-9(2)12/h4-6H,2,7H2,1,3H3
InChI Key:
MXWRDIIJPHVQMH-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1)C)CC(=C)Br

Properties

Complexity:
179  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.015g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
241.128g/mol
Monoisotopic Mass:
240.015g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8  

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