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5-Hydroxyanthranilic Acid

CAT: 0572-TRC-H801800-1GSize: 1 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-H801800-1GSize:1 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
394-31-0
Hazard Statement
Harmful if swallowed.
Purity
>95% (HPLC)
Smiles
Nc1ccc(O)cc1C(=O)O
Molecular Formula
C7 H7 N O3
Molecular Weight
153.14
InChI
InChI=1S/C7H7NO3/c8-6-2-1-4(9)3-5(6)7(10)11/h1-3,9H,8H2,(H,10,11)
Additionnal Information
IUPAC name: 2-amino-5-hydroxybenzoic acid
Shipping Conditions
Room Temperature
Storage Conditions
+20°C

Chemical Information

5-Hydroxyanthranilic acid

2-Amino-5-hydroxybenzoic acid is a hydroxybenzoic acid.

CAS Number394-31-0
PubChem CID164592
IUPAC Name2-amino-5-hydroxybenzoic acid
Molecular FormulaC7H7NO3
Molecular Weight153.14
XLogP0.6
Topological Polar Surface Area83.6
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Heavy Atom Count11
Formal Charge0
Complexity160
SMILES
C1=CC(=C(C=C1O)C(=O)O)N
InChI
InChI=1S/C7H7NO3/c8-6-2-1-4(9)3-5(6)7(10)11/h1-3,9H,8H2,(H,10,11)
InChIKey
HYNQTSZBTIOFKH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5-Hydroxyanthranilic acid
CAS: 394-31-0
CID: 164592
Formula: C7H7NO3
MW: 153.14
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight153.14
XLogP30.6
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass153.042593085
Monoisotopic Mass153.042593085
Topological Polar Surface Area83.6 Ų
Heavy Atom Count11
Formal Charge0
Complexity160
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes