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873300-24-4 | 2-[(Allyloxy)methyl]benzaldehyde
CAS No: 873300-24-4 Catalog No: AG01EY18 MDL No:
Product Description
Catalog Number:
AG01EY18
Chemical Name:
2-[(Allyloxy)methyl]benzaldehyde
CAS Number:
873300-24-4
Molecular Formula:
C11H12O2
Molecular Weight:
176.2118
IUPAC Name:
2-(prop-2-enoxymethyl)benzaldehyde
InChI:
InChI=1S/C11H12O2/c1-2-7-13-9-11-6-4-3-5-10(11)8-12/h2-6,8H,1,7,9H2
InChI Key:
SVQFXNMPSRBYEF-UHFFFAOYSA-N
SMILES:
C=CCOCc1ccccc1C=O
Properties
Complexity:
166
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.084g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
176.215g/mol
Monoisotopic Mass:
176.084g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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