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919994-84-6

919994-84-6 | 2-Naphthalenecarboxylic acid, 3-chloro-5-formyl-, ethyl ester

CAS No: 919994-84-6 Catalog No: AG006GBP MDL No:

Product Description

Catalog Number:
AG006GBP
Chemical Name:
2-Naphthalenecarboxylic acid, 3-chloro-5-formyl-, ethyl ester
CAS Number:
919994-84-6
Molecular Formula:
C14H11ClO3
Molecular Weight:
262.6883
IUPAC Name:
ethyl 3-chloro-5-formylnaphthalene-2-carboxylate
InChI:
InChI=1S/C14H11ClO3/c1-2-18-14(17)12-6-9-4-3-5-10(8-16)11(9)7-13(12)15/h3-8H,2H2,1H3
InChI Key:
BHNBJTRMUCLSGH-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cc2cccc(c2cc1Cl)C=O

Properties

Complexity:
318  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.04g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
262.689g/mol
Monoisotopic Mass:
262.04g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  

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