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92637-96-2 | Benzaldehyde, 2-(2-methoxyethoxy)-
CAS No: 92637-96-2 Catalog No: AG0062A4 MDL No:MFCD09036531
Product Description
Catalog Number:
AG0062A4
Chemical Name:
Benzaldehyde, 2-(2-methoxyethoxy)-
CAS Number:
92637-96-2
Molecular Formula:
C10H12O3
Molecular Weight:
180.2005
MDL Number:
MFCD09036531
IUPAC Name:
2-(2-methoxyethoxy)benzaldehyde
InChI:
InChI=1S/C10H12O3/c1-12-6-7-13-10-5-3-2-4-9(10)8-11/h2-5,8H,6-7H2,1H3
InChI Key:
VJJJRAXOBGTWAI-UHFFFAOYSA-N
SMILES:
COCCOc1ccccc1C=O
Properties
Complexity:
147
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.079g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
180.203g/mol
Monoisotopic Mass:
180.079g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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