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88153-33-7 | Benzaldehyde, 5-(hydroxymethyl)-2-[(2-methyl-1-propenyl)oxy]-
CAS No: 88153-33-7 Catalog No: AG004G09 MDL No:
Product Description
Catalog Number:
AG004G09
Chemical Name:
Benzaldehyde, 5-(hydroxymethyl)-2-[(2-methyl-1-propenyl)oxy]-
CAS Number:
88153-33-7
Molecular Formula:
C12H14O3
Molecular Weight:
206.2378
IUPAC Name:
5-(hydroxymethyl)-2-(2-methylprop-1-enoxy)benzaldehyde
InChI:
InChI=1S/C12H14O3/c1-9(2)8-15-12-4-3-10(6-13)5-11(12)7-14/h3-5,7-8,13H,6H2,1-2H3
InChI Key:
FBDGVJFXKYTWND-UHFFFAOYSA-N
SMILES:
O=Cc1cc(CO)ccc1OC=C(C)C
Properties
Complexity:
231
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.094g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
206.241g/mol
Monoisotopic Mass:
206.094g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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