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Home > Aldehydes > 855938-53-3
855938-53-3 | Benzaldehyde, 3-ethoxy-4-(formyloxy)-
CAS No: 855938-53-3 Catalog No: AG00514C MDL No:
Product Description
Catalog Number:
AG00514C
Chemical Name:
Benzaldehyde, 3-ethoxy-4-(formyloxy)-
CAS Number:
855938-53-3
Molecular Formula:
C10H10O4
Molecular Weight:
194.1840
IUPAC Name:
(2-ethoxy-4-formylphenyl) formate
InChI:
InChI=1S/C10H10O4/c1-2-13-10-5-8(6-11)3-4-9(10)14-7-12/h3-7H,2H2,1H3
InChI Key:
ABKHUUJYQMAZRZ-UHFFFAOYSA-N
SMILES:
CCOc1cc(C=O)ccc1OC=O
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.058g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
194.186g/mol
Monoisotopic Mass:
194.058g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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