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76280-61-0 | Benzaldehyde, 3,5-bis(methoxymethoxy)-
CAS No: 76280-61-0 Catalog No: AG005R2A MDL No:
Product Description
Catalog Number:
AG005R2A
Chemical Name:
Benzaldehyde, 3,5-bis(methoxymethoxy)-
CAS Number:
76280-61-0
Molecular Formula:
C11H14O5
Molecular Weight:
226.2259
IUPAC Name:
3,5-bis(methoxymethoxy)benzaldehyde
InChI:
InChI=1S/C11H14O5/c1-13-7-15-10-3-9(6-12)4-11(5-10)16-8-14-2/h3-6H,7-8H2,1-2H3
InChI Key:
RIKIEMNKLOZWEH-UHFFFAOYSA-N
SMILES:
COCOc1cc(OCOC)cc(c1)C=O
Properties
Complexity:
181
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.084g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
226.228g/mol
Monoisotopic Mass:
226.084g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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