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99-72-9

99-72-9 | Benzeneacetaldehyde, a,4-dimethyl-

CAS No: 99-72-9 Catalog No: AG01BXQ3 MDL No:MFCD00072170

Product Description

Catalog Number:
AG01BXQ3
Chemical Name:
Benzeneacetaldehyde, a,4-dimethyl-
CAS Number:
99-72-9
MDL Number:
MFCD00072170
IUPAC Name:
2-(4-methylphenyl)propanal
InChI:
InChI=1S/C10H12O/c1-8-3-5-10(6-4-8)9(2)7-11/h3-7,9H,1-2H3
InChI Key:
JTZWVKUZBNHSSW-UHFFFAOYSA-N
EC Number:
202-782-0
FEMA Number:
3078

Properties

Complexity:
123  
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:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  

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