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Home > Aldehydes > 2137702-14-6
2137702-14-6 | 4-(1,3-dioxolan-2-yl)-2,5-dimethylbenzaldehyde
CAS No: 2137702-14-6 Catalog No: AG01EMCN MDL No:MFCD31421666
Product Description
Catalog Number:
AG01EMCN
Chemical Name:
4-(1,3-dioxolan-2-yl)-2,5-dimethylbenzaldehyde
CAS Number:
2137702-14-6
Molecular Formula:
C12H14O3
Molecular Weight:
206.2378
MDL Number:
MFCD31421666
IUPAC Name:
4-(1,3-dioxolan-2-yl)-2,5-dimethylbenzaldehyde
InChI:
InChI=1S/C12H14O3/c1-8-6-11(12-14-3-4-15-12)9(2)5-10(8)7-13/h5-7,12H,3-4H2,1-2H3
InChI Key:
PMRJAELZFWZENL-UHFFFAOYSA-N
SMILES:
O=Cc1cc(C)c(cc1C)C1OCCO1
Properties
Complexity:
223
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:
0
Isotope Atom Count:
0
Molecular Weight:
206.241g/mol
Monoisotopic Mass:
206.094g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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