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93614-80-3

93614-80-3 | (E)-3-(m-Tolyl)acrylaldehyde

CAS No: 93614-80-3 Catalog No: AG003JR0 MDL No:MFCD08460293

Product Description

Catalog Number:
AG003JR0
Chemical Name:
(E)-3-(m-Tolyl)acrylaldehyde
CAS Number:
93614-80-3
Molecular Formula:
C10H10O
Molecular Weight:
146.1858
MDL Number:
MFCD08460293
IUPAC Name:
(E)-3-(3-methylphenyl)prop-2-enal
InChI:
InChI=1S/C10H10O/c1-9-4-2-5-10(8-9)6-3-7-11/h2-8H,1H3/b6-3+
InChI Key:
SJLLZWMNPJCLBC-ZZXKWVIFSA-N
SMILES:
O=C/C=C/c1cccc(c1)C

Properties

Complexity:
149  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
146.073g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
146.189g/mol
Monoisotopic Mass:
146.073g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  

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