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Home > Aldehydes > 100207-94-1
100207-94-1 | [1,1'-Biphenyl]-4,4'-dicarboxaldehyde, 2,2'-dimethyl-
CAS No: 100207-94-1 Catalog No: AG00018M MDL No:
Product Description
Catalog Number:
AG00018M
Chemical Name:
[1,1'-Biphenyl]-4,4'-dicarboxaldehyde, 2,2'-dimethyl-
CAS Number:
100207-94-1
Molecular Formula:
C16H14O2
Molecular Weight:
238.2812
IUPAC Name:
4-(4-formyl-2-methylphenyl)-3-methylbenzaldehyde
InChI:
InChI=1S/C16H14O2/c1-11-7-13(9-17)3-5-15(11)16-6-4-14(10-18)8-12(16)2/h3-10H,1-2H3
InChI Key:
CEWMBSPNHLMSLU-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(c(c1)C)c1ccc(cc1C)C=O
Properties
Complexity:
270
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.099g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
238.286g/mol
Monoisotopic Mass:
238.099g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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