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88632-96-6 | 1H-Indene-5-carboxaldehyde, 6-ethyl-2,3-dihydro-4,7-dimethyl-
CAS No: 88632-96-6 Catalog No: AG0049UC MDL No:
Product Description
Catalog Number:
AG0049UC
Chemical Name:
1H-Indene-5-carboxaldehyde, 6-ethyl-2,3-dihydro-4,7-dimethyl-
CAS Number:
88632-96-6
Molecular Formula:
C14H18O
Molecular Weight:
202.2921
IUPAC Name:
6-ethyl-4,7-dimethyl-2,3-dihydro-1H-indene-5-carbaldehyde
InChI:
InChI=1S/C14H18O/c1-4-11-9(2)12-6-5-7-13(12)10(3)14(11)8-15/h8H,4-7H2,1-3H3
InChI Key:
BGFNEEWLVWJMAM-UHFFFAOYSA-N
SMILES:
CCc1c(C=O)c(C)c2c(c1C)CCC2
Properties
Complexity:
236
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.136g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
202.297g/mol
Monoisotopic Mass:
202.136g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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