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141052-31-5 | 7-Bromo-4-methylquinoline
CAS No: 141052-31-5 Catalog No: AG001FTD MDL No:MFCD18204665
Product Description
Catalog Number:
AG001FTD
Chemical Name:
7-Bromo-4-methylquinoline
CAS Number:
141052-31-5
Molecular Formula:
C10H8BrN
Molecular Weight:
222.0812
MDL Number:
MFCD18204665
IUPAC Name:
7-bromo-4-methylquinoline
InChI:
InChI=1S/C10H8BrN/c1-7-4-5-12-10-6-8(11)2-3-9(7)10/h2-6H,1H3
InChI Key:
AGMXSOARXXPPIJ-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)nccc2C
Properties
Complexity:
160
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.984g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.085g/mol
Monoisotopic Mass:
220.984g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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