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68083-54-5 | (4-ETHYLPHENYL)ACETALDEHYDE
CAS No: 68083-54-5 Catalog No: AG006G2U MDL No:
Product Description
Catalog Number:
AG006G2U
Chemical Name:
(4-ETHYLPHENYL)ACETALDEHYDE
CAS Number:
68083-54-5
Molecular Formula:
C10H12O
Molecular Weight:
148.2017
IUPAC Name:
2-(4-ethylphenyl)acetaldehyde
InChI:
InChI=1S/C10H12O/c1-2-9-3-5-10(6-4-9)7-8-11/h3-6,8H,2,7H2,1H3
InChI Key:
PWBRLMKOCGLZAH-UHFFFAOYSA-N
SMILES:
CCc1ccc(cc1)CC=O
EC Number:
268-403-6
Properties
Complexity:
112
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
148.089g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
148.205g/mol
Monoisotopic Mass:
148.089g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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