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16650-52-5 | 1-Naphthalenecarboxylic acid, 5-chloro-
CAS No: 16650-52-5 Catalog No: AG001WSM MDL No:MFCD03259900
Product Description
Catalog Number:
AG001WSM
Chemical Name:
1-Naphthalenecarboxylic acid, 5-chloro-
CAS Number:
16650-52-5
Molecular Formula:
C11H7ClO2
Molecular Weight:
206.6251
MDL Number:
MFCD03259900
IUPAC Name:
5-chloronaphthalene-1-carboxylic acid
InChI:
InChI=1S/C11H7ClO2/c12-10-6-2-3-7-8(10)4-1-5-9(7)11(13)14/h1-6H,(H,13,14)
InChI Key:
CPGDMBASSDNQIS-UHFFFAOYSA-N
SMILES:
OC(=O)c1cccc2c1cccc2Cl
Properties
Complexity:
229
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.013g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
206.625g/mol
Monoisotopic Mass:
206.013g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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