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2394-20-9

2394-20-9 | Benzeneacetic acid, a,4-dihydroxy-3-methoxy-, (±)-

CAS No: 2394-20-9 Catalog No: AG003PT4 MDL No:MFCD00004235

Product Description

Catalog Number:
AG003PT4
Chemical Name:
Benzeneacetic acid, a,4-dihydroxy-3-methoxy-, (±)-
CAS Number:
2394-20-9
MDL Number:
MFCD00004235
IUPAC Name:
2-hydroxy-2-(4-hydroxy-3-methoxyphenyl)acetic acid
InChI:
InChI=1S/C9H10O5/c1-14-7-4-5(2-3-6(7)10)8(11)9(12)13/h2-4,8,10-11H,1H3,(H,12,13)
InChI Key:
CGQCWMIAEPEHNQ-UHFFFAOYSA-N
EC Number:
200-224-0
FEMA Number:
4660

Properties

Complexity:
205  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.053g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
198.174g/mol
Monoisotopic Mass:
198.053g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
87A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2  

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