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79075-32-4 | Naphthalenecarboxaldehyde, dimethyl-
CAS No: 79075-32-4 Catalog No: AG005BQW MDL No:
Product Description
Catalog Number:
AG005BQW
Chemical Name:
Naphthalenecarboxaldehyde, dimethyl-
CAS Number:
79075-32-4
Molecular Formula:
C13H12O
Molecular Weight:
184.2338
IUPAC Name:
2,3-dimethylnaphthalene-1-carbaldehyde
InChI:
InChI=1S/C13H12O/c1-9-7-11-5-3-4-6-12(11)13(8-14)10(9)2/h3-8H,1-2H3
InChI Key:
KCKAGGPNSPNAOR-UHFFFAOYSA-N
SMILES:
O=Cc1c(C)c(C)cc2c1cccc2
Properties
Complexity:
211
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.089g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
184.238g/mol
Monoisotopic Mass:
184.089g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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