Home Aldehydes 1,3-Benzenedicarboxaldehyde, 5-methoxy-

1,3-Benzenedicarboxaldehyde, 5-methoxy-

CAS No.:
90560-22-8
Catalog Number:
AG00GZS3
Molecular Formula:
C9H8O3
Molecular Weight:
164.1580
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Product Description
Catalog Number:
AG00GZS3
Chemical Name:
1,3-Benzenedicarboxaldehyde, 5-methoxy-
CAS Number:
90560-22-8
Molecular Formula:
C9H8O3
Molecular Weight:
164.1580
MDL Number:
MFCD08690081
IUPAC Name:
5-methoxybenzene-1,3-dicarbaldehyde
InChI:
InChI=1S/C9H8O3/c1-12-9-3-7(5-10)2-8(4-9)6-11/h2-6H,1H3
InChI Key:
OYFIDJNXLPYIAJ-UHFFFAOYSA-N
SMILES:
COc1cc(C=O)cc(c1)C=O
Properties
Complexity:
151  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.047g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
164.16g/mol
Monoisotopic Mass:
164.047g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties