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75889-47-3

75889-47-3 | Benzaldehyde, 2,3-dimethoxy-4-methyl-

CAS No: 75889-47-3 Catalog No: AG005HD0 MDL No:MFCD20923635

Product Description

Catalog Number:
AG005HD0
Chemical Name:
Benzaldehyde, 2,3-dimethoxy-4-methyl-
CAS Number:
75889-47-3
Molecular Formula:
C10H12O3
Molecular Weight:
180.2005
MDL Number:
MFCD20923635
IUPAC Name:
2,3-dimethoxy-4-methylbenzaldehyde
InChI:
InChI=1S/C10H12O3/c1-7-4-5-8(6-11)10(13-3)9(7)12-2/h4-6H,1-3H3
InChI Key:
QBIKTQKJHRUMDE-UHFFFAOYSA-N
SMILES:
COc1c(C=O)ccc(c1OC)C

Properties

Complexity:
170  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.079g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
180.203g/mol
Monoisotopic Mass:
180.079g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  

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