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77468-38-3 | [1,1'-Biphenyl]carboxaldehyde,methyl- (9CI)
CAS No: 77468-38-3 Catalog No: AG005LEZ MDL No:
Product Description
Catalog Number:
AG005LEZ
Chemical Name:
[1,1'-Biphenyl]carboxaldehyde,methyl- (9CI)
CAS Number:
77468-38-3
Molecular Formula:
C14H12O
Molecular Weight:
196.2445
IUPAC Name:
2-methyl-6-phenylbenzaldehyde
InChI:
InChI=1S/C14H12O/c1-11-6-5-9-13(14(11)10-15)12-7-3-2-4-8-12/h2-10H,1H3
InChI Key:
DEYDDEZRKCIBBM-UHFFFAOYSA-N
SMILES:
O=Cc1c(C)cccc1c1ccccc1
Properties
Complexity:
205
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.089g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
196.249g/mol
Monoisotopic Mass:
196.089g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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