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3491-63-2,MFCD00051835
Catalog No.:AA003HS9
3491-63-2 | 2-Phenyl-2-pentenal
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1g
1 week  
$179.00   $125.00
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5g
1 week  
$293.00   $205.00
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10g
1 week  
$449.00   $314.00
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25g
1 week  
$761.00   $533.00
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Technical Information
Catalog Number:
AA003HS9
Chemical Name:
2-Phenyl-2-pentenal
CAS Number:
3491-63-2
Molecular Formula:
C11H12O
Molecular Weight:
160.2124
MDL Number:
MFCD00051835
IUPAC Name:
(E)-2-phenylpent-2-enal
InChI:
InChI=1S/C11H12O/c1-2-6-11(9-12)10-7-4-3-5-8-10/h3-9H,2H2,1H3/b11-6-
InChI Key:
YPAJRUMMODCONM-WDZFZDKYSA-N
SMILES:
CC/C=C(\c1ccccc1)/C=O
EC Number:
609-046-1
Properties
Computed Properties
 
Complexity:
164  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
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:
2.6  

Synonyms
 
2-Phenylpent-2-enal 
2-Phenyl-2-pentenal 
AC1O518G 
SCHEMBL2171577 
2-Phenyl-2-pentenal, AldrichCPR 
ZINC2510135 
AKOS006229373 
ACM3491632 
AN-20228 
ST50827137 
Benzeneacetaldehyde, ?-propylidene- 
C11-H12-O 
3491-63-2 
ZINC02510135 
CID6450204 
Benzeneacetaldehyde, .alpha.-propylidene- 
(E)-2-phenylpent-2-enal 
2-Phenyl-2-pentenal, (E)+(Z) 
MFCD00051835 
Benzeneacetaldehyde, alpha-propylidene- 
AC1Q2CA1 
(E)-2-Phenyl-2-pentenal 
(2E)-2-phenylpent-2-enal 
Literature
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