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74327-91-6 | Benzaldehyde, 3,4,5-trimethoxy-2-methyl-
CAS No: 74327-91-6 Catalog No: AG005Y5B MDL No:
Product Description
Catalog Number:
AG005Y5B
Chemical Name:
Benzaldehyde, 3,4,5-trimethoxy-2-methyl-
CAS Number:
74327-91-6
Molecular Formula:
C11H14O4
Molecular Weight:
210.2265
IUPAC Name:
3,4,5-trimethoxy-2-methylbenzaldehyde
InChI:
InChI=1S/C11H14O4/c1-7-8(6-12)5-9(13-2)11(15-4)10(7)14-3/h5-6H,1-4H3
InChI Key:
HHKQIKPHIVIJQS-UHFFFAOYSA-N
SMILES:
COc1cc(C=O)c(c(c1OC)OC)C
Properties
Complexity:
207
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.089g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
210.229g/mol
Monoisotopic Mass:
210.089g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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