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820237-15-8 | Benzaldehyde,4-(cyclopentyloxy)-2,3-dimethyl-
CAS No: 820237-15-8 Catalog No: AG005D9C MDL No:
Product Description
Catalog Number:
AG005D9C
Chemical Name:
Benzaldehyde,4-(cyclopentyloxy)-2,3-dimethyl-
CAS Number:
820237-15-8
Molecular Formula:
C14H18O2
Molecular Weight:
218.2915
IUPAC Name:
4-cyclopentyloxy-2,3-dimethylbenzaldehyde
InChI:
InChI=1S/C14H18O2/c1-10-11(2)14(8-7-12(10)9-15)16-13-5-3-4-6-13/h7-9,13H,3-6H2,1-2H3
InChI Key:
IPAPROKNBLUCKR-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(c(c1C)C)OC1CCCC1
Properties
Complexity:
233
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.131g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
218.296g/mol
Monoisotopic Mass:
218.131g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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