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134271-45-7

134271-45-7 | Benzene, 1-(bromomethyl)-2-chloro-3-methyl-

CAS No: 134271-45-7 Catalog No: AG01FAX6 MDL No:

Product Description

Catalog Number:
AG01FAX6
Chemical Name:
Benzene, 1-(bromomethyl)-2-chloro-3-methyl-
CAS Number:
134271-45-7
Molecular Formula:
C8H8BrCl
Molecular Weight:
219.5061
IUPAC Name:
1-(bromomethyl)-2-chloro-3-methylbenzene
InChI:
InChI=1S/C8H8BrCl/c1-6-3-2-4-7(5-9)8(6)10/h2-4H,5H2,1H3
InChI Key:
MCEYVJFKCOFDCS-UHFFFAOYSA-N
SMILES:
BrCc1cccc(c1Cl)C

Properties

Complexity:
105  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.95g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
219.506g/mol
Monoisotopic Mass:
217.95g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  

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