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41052-88-4 | 3-ALLYL-4-HYDROXYBENZALDEHYDE
CAS No: 41052-88-4 Catalog No: AG0073D3 MDL No:MFCD06290488
Product Description
Catalog Number:
AG0073D3
Chemical Name:
3-ALLYL-4-HYDROXYBENZALDEHYDE
CAS Number:
41052-88-4
Molecular Formula:
C10H10O2
Molecular Weight:
162.1852
MDL Number:
MFCD06290488
IUPAC Name:
4-hydroxy-3-prop-2-enylbenzaldehyde
InChI:
InChI=1S/C10H10O2/c1-2-3-9-6-8(7-11)4-5-10(9)12/h2,4-7,12H,1,3H2
InChI Key:
HDZJQLIQQWIJBW-UHFFFAOYSA-N
SMILES:
C=CCc1cc(C=O)ccc1O
Properties
Complexity:
165
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.068g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
162.188g/mol
Monoisotopic Mass:
162.068g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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