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144164-15-8 | BENZENEACETALDEHYDE
CAS No: 144164-15-8 Catalog No: AG00AM69 MDL No:MFCD02261754
Product Description
Catalog Number:
AG00AM69
Chemical Name:
BENZENEACETALDEHYDE
CAS Number:
144164-15-8
Molecular Formula:
C10H12O
Molecular Weight:
148.2017
MDL Number:
MFCD02261754
IUPAC Name:
2-(3,5-dimethylphenyl)acetaldehyde
InChI:
InChI=1S/C10H12O/c1-8-5-9(2)7-10(6-8)3-4-11/h4-7H,3H2,1-2H3
InChI Key:
PMHGYQMHCQYIRL-UHFFFAOYSA-N
SMILES:
O=CCc1cc(C)cc(c1)C
Properties
Complexity:
121
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:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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