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87700-64-9 | 1-Naphthalenecarbonyl chloride, 4-chloro-
CAS No: 87700-64-9 Catalog No: AG004NCM MDL No:
Product Description
Catalog Number:
AG004NCM
Chemical Name:
1-Naphthalenecarbonyl chloride, 4-chloro-
CAS Number:
87700-64-9
Molecular Formula:
C11H6Cl2O
Molecular Weight:
225.0707
IUPAC Name:
4-chloronaphthalene-1-carbonyl chloride
InChI:
InChI=1S/C11H6Cl2O/c12-10-6-5-9(11(13)14)7-3-1-2-4-8(7)10/h1-6H
InChI Key:
YIJBOJSNMCCAIY-UHFFFAOYSA-N
SMILES:
ClC(=O)c1ccc(c2c1cccc2)Cl
Properties
Complexity:
229
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.98g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
225.068g/mol
Monoisotopic Mass:
223.98g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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