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2-Amino-3-hydroxybenzoic acid

ChemSpider ID: 13858172
Molecular Formula: C₇H₇NO₃
Monoisotopic mass: 153.042587 Da
Systematic name

2-Amino-3-hydroxybenzoic acid
SMILES and InChIs

SMILES:

Nc1c(cccc1O)C(O)=O Copied

Std. InChI:

InChI=1S/C7H7NO3/c8-6-4(7(10)11)2-1-3-5(6)9/h1-3,9H,8H2,(H,10,11) Copied

Std. InChIKey:

WJXSWCUQABXPFS-UHFFFAOYSA-N Copied

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Properties

Predicted - ACD/Labs
Predicted - ChemAxon

Predicted data is generated using the ACD/Labs’ ACD/PhysChem Suite, for more information see their website.

ACD/LogP:	1.055	# of Rule of 5 Violations:	0
ACD/LogD (pH 5.5):	-0.18	ACD/LogD (pH 7.4):	-1.77
ACD/BCF (pH 5.5):	1.00	ACD/BCF (pH 7.4):	1.00
ACD/KOC (pH 5.5):	5.18	ACD/KOC (pH 7.4):	1.00
#H bond acceptors:	4	#H bond donors:	4
#Freely Rotating Bonds:	3	Polar Surface Area:	83.55 Å²
Index of Refraction:	1.691	Molar Refractivity:	39.301 cm³
Molar Volume:	102.673 cm³	Polarizability:	15.58 10^-24cm³
Surface Tension:	83.370002746582 dyne/cm	Density:	1.492 g/cm³
Flash Point:	169.617 °C	Enthalpy of Vaporization:	63.539 kJ/mol
Boiling Point:	356.85 °C at 760 mmHg	Vapour Pressure:	0 mmHg at 25°C

Click to predict properties on the Chemicalize site

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