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Home > Aldehydes > 179554-11-1
179554-11-1 | Benzaldehyde, 2-methyl-6-(2-propen-1-yl)-
CAS No: 179554-11-1 Catalog No: AG00273Z MDL No:
Product Description
Catalog Number:
AG00273Z
Chemical Name:
Benzaldehyde, 2-methyl-6-(2-propen-1-yl)-
CAS Number:
179554-11-1
Molecular Formula:
C11H12O
Molecular Weight:
160.2124
IUPAC Name:
2-methyl-6-prop-2-enylbenzaldehyde
InChI:
InChI=1S/C11H12O/c1-3-5-10-7-4-6-9(2)11(10)8-12/h3-4,6-8H,1,5H2,2H3
InChI Key:
XNWGAMJBUFPQED-UHFFFAOYSA-N
SMILES:
C=CCc1cccc(c1C=O)C
Properties
Complexity:
162
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.089g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
160.216g/mol
Monoisotopic Mass:
160.089g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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