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88339-49-5 | Benzaldehyde, 3-(methoxymethyl)-2,4,5,6-tetramethyl-
CAS No: 88339-49-5 Catalog No: AG0089MX MDL No:
Product Description
Catalog Number:
AG0089MX
Chemical Name:
Benzaldehyde, 3-(methoxymethyl)-2,4,5,6-tetramethyl-
CAS Number:
88339-49-5
Molecular Formula:
C13H18O2
Molecular Weight:
206.2808
IUPAC Name:
3-(methoxymethyl)-2,4,5,6-tetramethylbenzaldehyde
InChI:
InChI=1S/C13H18O2/c1-8-9(2)12(6-14)11(4)13(7-15-5)10(8)3/h6H,7H2,1-5H3
InChI Key:
AMQRQAKTZLBLDT-UHFFFAOYSA-N
SMILES:
COCc1c(C)c(C=O)c(c(c1C)C)C
Properties
Complexity:
215
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.131g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
206.285g/mol
Monoisotopic Mass:
206.131g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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