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21156-91-2

21156-91-2 | 3-allylbenzaldehyde

CAS No: 21156-91-2 Catalog No: AG00BKMF MDL No:MFCD17015442

Product Description

Catalog Number:
AG00BKMF
Chemical Name:
3-allylbenzaldehyde
CAS Number:
21156-91-2
Molecular Formula:
C10H10O
Molecular Weight:
146.1858
MDL Number:
MFCD17015442
IUPAC Name:
3-prop-2-enylbenzaldehyde
InChI:
InChI=1S/C10H10O/c1-2-4-9-5-3-6-10(7-9)8-11/h2-3,5-8H,1,4H2
InChI Key:
KUEDNSFBFPTFIA-UHFFFAOYSA-N
SMILES:
C=CCc1cccc(c1)C=O

Properties

Complexity:
140  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
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:
3  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  

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