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70935-14-7 | 2-(3-hydroxyphenyl)-2-oxoacetaldehyde
CAS No: 70935-14-7 Catalog No: AG01BGBK MDL No:MFCD12031505
Product Description
Catalog Number:
AG01BGBK
Chemical Name:
2-(3-hydroxyphenyl)-2-oxoacetaldehyde
CAS Number:
70935-14-7
Molecular Formula:
C8H6O3
Molecular Weight:
150.1314
MDL Number:
MFCD12031505
IUPAC Name:
2-(3-hydroxyphenyl)-2-oxoacetaldehyde
InChI:
InChI=1S/C8H6O3/c9-5-8(11)6-2-1-3-7(10)4-6/h1-5,10H
InChI Key:
BFHONQWJUMCAKI-UHFFFAOYSA-N
SMILES:
O=CC(=O)c1cccc(c1)O
Properties
Complexity:
165
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
150.032g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
150.133g/mol
Monoisotopic Mass:
150.032g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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