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234098-35-2 | Quinazoline, 7-(bromomethyl)-4-chloro-
CAS No: 234098-35-2 Catalog No: AG002N53 MDL No:
Product Description
Catalog Number:
AG002N53
Chemical Name:
Quinazoline, 7-(bromomethyl)-4-chloro-
CAS Number:
234098-35-2
Molecular Formula:
C9H6BrClN2
Molecular Weight:
257.5143
IUPAC Name:
7-(bromomethyl)-4-chloroquinazoline
InChI:
InChI=1S/C9H6BrClN2/c10-4-6-1-2-7-8(3-6)12-5-13-9(7)11/h1-3,5H,4H2
InChI Key:
YXMZSPUJMICFKD-UHFFFAOYSA-N
SMILES:
BrCc1ccc2c(c1)ncnc2Cl
Properties
Complexity:
179
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.94g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
257.515g/mol
Monoisotopic Mass:
255.94g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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