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138823-81-1 | Pyridine, 3-chloro-4-(phenylmethyl)-
CAS No: 138823-81-1 Catalog No: AG0019N3 MDL No:
Product Description
Catalog Number:
AG0019N3
Chemical Name:
Pyridine, 3-chloro-4-(phenylmethyl)-
CAS Number:
138823-81-1
Molecular Formula:
C12H10ClN
Molecular Weight:
203.6675
IUPAC Name:
4-benzyl-3-chloropyridine
InChI:
InChI=1S/C12H10ClN/c13-12-9-14-7-6-11(12)8-10-4-2-1-3-5-10/h1-7,9H,8H2
InChI Key:
CONPZSMMPSXXNH-UHFFFAOYSA-N
SMILES:
Clc1cnccc1Cc1ccccc1
Properties
Complexity:
166
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.05g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
203.669g/mol
Monoisotopic Mass:
203.05g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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