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77785-94-5 | Benzaldehyde,4-(2-propen-1-yl)-
CAS No: 77785-94-5 Catalog No: AG008OE9 MDL No:MFCD18824440
Product Description
Catalog Number:
AG008OE9
Chemical Name:
Benzaldehyde,4-(2-propen-1-yl)-
CAS Number:
77785-94-5
Molecular Formula:
C10H10O
Molecular Weight:
146.1858
MDL Number:
MFCD18824440
IUPAC Name:
4-prop-2-enylbenzaldehyde
InChI:
InChI=1S/C10H10O/c1-2-3-9-4-6-10(8-11)7-5-9/h2,4-8H,1,3H2
InChI Key:
VBZGCBZCEGCNPR-UHFFFAOYSA-N
SMILES:
C=CCc1ccc(cc1)C=O
Properties
Complexity:
132
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:
2.5
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