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17580-69-7 | Benzaldehyde, 2-hydroxy-5-methoxy-, oxime
CAS No: 17580-69-7 Catalog No: AG002178 MDL No:
Product Description
Catalog Number:
AG002178
Chemical Name:
Benzaldehyde, 2-hydroxy-5-methoxy-, oxime
CAS Number:
17580-69-7
Molecular Formula:
C8H9NO3
Molecular Weight:
167.1620
IUPAC Name:
2-(hydroxyiminomethyl)-4-methoxyphenol
InChI:
InChI=1S/C8H9NO3/c1-12-7-2-3-8(10)6(4-7)5-9-11/h2-5,10-11H,1H3
InChI Key:
UFLSRRHSCGPKAE-UHFFFAOYSA-N
SMILES:
ON=Cc1cc(OC)ccc1O
Properties
Complexity:
160
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.058g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
167.164g/mol
Monoisotopic Mass:
167.058g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
62A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.3
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