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68348-23-2 | Benzaldehyde, 3-(1,3-dioxolan-2-yl)-
CAS No: 68348-23-2 Catalog No: AG006LVZ MDL No:
Product Description
Catalog Number:
AG006LVZ
Chemical Name:
Benzaldehyde, 3-(1,3-dioxolan-2-yl)-
CAS Number:
68348-23-2
Molecular Formula:
C10H10O3
Molecular Weight:
178.1846
IUPAC Name:
3-(1,3-dioxolan-2-yl)benzaldehyde
InChI:
InChI=1S/C10H10O3/c11-7-8-2-1-3-9(6-8)10-12-4-5-13-10/h1-3,6-7,10H,4-5H2
InChI Key:
LVHULPFZAXZJBD-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(c1)C1OCCO1
Properties
Complexity:
175
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.063g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
178.187g/mol
Monoisotopic Mass:
178.063g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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