Home Aldehydes Benzaldehyde, 3-ethenyl-

Benzaldehyde, 3-ethenyl-

CAS No.:
19955-99-8
Catalog Number:
AG002C6I
Molecular Formula:
C9H8O
Molecular Weight:
132.1592
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Product Description
Catalog Number:
AG002C6I
Chemical Name:
Benzaldehyde, 3-ethenyl-
CAS Number:
19955-99-8
Molecular Formula:
C9H8O
Molecular Weight:
132.1592
MDL Number:
MFCD02093761
IUPAC Name:
3-ethenylbenzaldehyde
InChI:
InChI=1S/C9H8O/c1-2-8-4-3-5-9(6-8)7-10/h2-7H,1H2
InChI Key:
CATOVPRCMWIZLR-UHFFFAOYSA-N
SMILES:
C=Cc1cccc(c1)C=O
Properties
Complexity:
129  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
132.058g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
132.162g/mol
Monoisotopic Mass:
132.058g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Literature
Title Journal
A versatile approach to high-throughput microarrays using thiol-ene chemistry. Nature chemistry 20100201
Properties