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4-Amino-3-hydroxybenzoic acid

CAT: 0013-GTR19245765-01Size: 50 gDry Ice: NoHazardous: No
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Description
4-Amino-3-hydroxybenzoic acid is a biochemical reagent that can be used as a biomaterial for life science related research and as a sulfonylation reagent for organic synthesis and drug discovery.
CAS Number
2374-03-0
Smiles
NC1=CC=C (C (O) =O) C=C1O
Molecular Formula
C7H7NO3
Molecular Weight
153.1354
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

4-Amino-3-hydroxybenzoic acid

structure in first source

CAS Number2374-03-0
PubChem CID137566
IUPAC Name4-amino-3-hydroxybenzoic acid
Molecular FormulaC7H7NO3
Molecular Weight153.14
XLogP0.8
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=C1C(=O)O)O)N
InChI
InChI=1S/C7H7NO3/c8-5-2-1-4(7(10)11)3-6(5)9/h1-3,9H,8H2,(H,10,11)
InChIKey
NFPYJDZQOKCYIE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-Amino-3-hydroxybenzoic acid
CAS: 2374-03-0
CID: 137566
Formula: C7H7NO3
MW: 153.14
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight153.14
XLogP30.8
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

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