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1443333-46-7 | 2,6-Dimethyl-4-iso-pentoxybenzaldehyde
CAS No: 1443333-46-7 Catalog No: AG01FCR9 MDL No:
Product Description
Catalog Number:
AG01FCR9
Chemical Name:
2,6-Dimethyl-4-iso-pentoxybenzaldehyde
CAS Number:
1443333-46-7
Molecular Formula:
C14H20O2
Molecular Weight:
220.3074
IUPAC Name:
2,6-dimethyl-4-(3-methylbutoxy)benzaldehyde
InChI:
InChI=1S/C14H20O2/c1-10(2)5-6-16-13-7-11(3)14(9-15)12(4)8-13/h7-10H,5-6H2,1-4H3
InChI Key:
FFHZUGCQWBLNMF-UHFFFAOYSA-N
SMILES:
O=Cc1c(C)cc(cc1C)OCCC(C)C
Properties
Complexity:
201
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.146g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
220.312g/mol
Monoisotopic Mass:
220.146g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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