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143536-49-6 | Acetaldehyde, [(3-hydroxyphenyl)methoxy]-
CAS No: 143536-49-6 Catalog No: AG006URU MDL No:
Product Description
Catalog Number:
AG006URU
Chemical Name:
Acetaldehyde, [(3-hydroxyphenyl)methoxy]-
CAS Number:
143536-49-6
Molecular Formula:
C9H10O3
Molecular Weight:
166.1739
IUPAC Name:
2-[(3-hydroxyphenyl)methoxy]acetaldehyde
InChI:
InChI=1S/C9H10O3/c10-4-5-12-7-8-2-1-3-9(11)6-8/h1-4,6,11H,5,7H2
InChI Key:
MXTJGBOBRYMFKX-UHFFFAOYSA-N
SMILES:
O=CCOCc1cccc(c1)O
Properties
Complexity:
136
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.063g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
166.176g/mol
Monoisotopic Mass:
166.063g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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