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864779-06-6 | 4-(Bromomethyl)-2-methylquinoline
CAS No: 864779-06-6 Catalog No: AG004QP5 MDL No:MFCD13688992
Product Description
Catalog Number:
AG004QP5
Chemical Name:
4-(Bromomethyl)-2-methylquinoline
CAS Number:
864779-06-6
Molecular Formula:
C11H10BrN
Molecular Weight:
236.1078
MDL Number:
MFCD13688992
IUPAC Name:
4-(bromomethyl)-2-methylquinoline
InChI:
InChI=1S/C11H10BrN/c1-8-6-9(7-12)10-4-2-3-5-11(10)13-8/h2-6H,7H2,1H3
InChI Key:
STFAUTYDNFEXJW-UHFFFAOYSA-N
SMILES:
BrCc1cc(C)nc2c1cccc2
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.112g/mol
Monoisotopic Mass:
235g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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