Home Aldehydes 2-Methyl-1,4-benzenedicarbaldehyde

2-Methyl-1,4-benzenedicarbaldehyde

CAS No.:
27587-17-3
Catalog Number:
AG00CEFB
Molecular Formula:
C9H8O2
Molecular Weight:
148.1586
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Product Description
Catalog Number:
AG00CEFB
Chemical Name:
2-Methyl-1,4-benzenedicarbaldehyde
CAS Number:
27587-17-3
Molecular Formula:
C9H8O2
Molecular Weight:
148.1586
MDL Number:
MFCD22374547
IUPAC Name:
2-methylterephthalaldehyde
InChI:
InChI=1S/C9H8O2/c1-7-4-8(5-10)2-3-9(7)6-11/h2-6H,1H3
InChI Key:
MNHWRUCVFATHDL-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(c(c1)C)C=O
Properties
Complexity:
154  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
148.052g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
148.161g/mol
Monoisotopic Mass:
148.052g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties