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Home > Aldehydes > 197513-69-2
197513-69-2 | Benzaldehyde, 4-(3,6,9,12-tetraoxatridec-1-yloxy)-
CAS No: 197513-69-2 Catalog No: AG002AUV MDL No:
Product Description
Catalog Number:
AG002AUV
Chemical Name:
Benzaldehyde, 4-(3,6,9,12-tetraoxatridec-1-yloxy)-
CAS Number:
197513-69-2
Molecular Formula:
C16H24O6
Molecular Weight:
312.3582
IUPAC Name:
4-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]benzaldehyde
InChI:
InChI=1S/C16H24O6/c1-18-6-7-19-8-9-20-10-11-21-12-13-22-16-4-2-15(14-17)3-5-16/h2-5,14H,6-13H2,1H3
InChI Key:
BTPTYEGOHOHWCF-UHFFFAOYSA-N
SMILES:
COCCOCCOCCOCCOc1ccc(cc1)C=O
Properties
Complexity:
253
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
312.157g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
312.362g/mol
Monoisotopic Mass:
312.157g/mol
Rotatable Bond Count:
14
Topological Polar Surface Area:
63.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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