UCSF

ZINC00388166

Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2005 11 No

Other Names:

"2,3-Dihydroxybenzoic acid, 99%"

2,3 DHB; 2,3-Dihydroxybenzoic acid; 2-Pyrocatechuic acid; 3-Hydroxysalicylic acid; BRN 2209117; Benzoic acid, 2,3-dihydroxy-; Catecholcarboxylic acid; DHBA; DOBK; EINECS 206-139-5; LS-37057; NSC 27435; Pyrocatechuic acid; o-Pyrocatechuic acid (6CI,8CI)

2,3 DHB; 2-pyrocatechuic acid; 3-hydroxysalicylic acid; DOBK; catechol-3-carboxylic acid; o-pyrocatechuic acid; pyrocatechuic acid

2,3-DIHDROXYBENZOIC ACID

2,3-Dihydroxy-Benzoic Acid

2,3-dihydroxybenzoate; 2,3-dihydroxybenzoic acid; 2-3-DIHYDROXYBENZOATE; 2-pyrocatechuate; 3-hydroxysalicylate; 303-38-8; catechol-3-carboxylate

2,3-dihydroxybenzoate; 2,3-Dihydroxybenzoic acid; 2-Pyrocatechuic acid; 2-pyrocatechuic acid; 3-Hydroxysalicylic acid; Catecholcarboxylic acid; DHBA; DOBK; o-Pyrocatechuic acid; Pyrocatechuic acid

2,3-Dihydroxybenzoate; 2,3-Dihydroxybenzoic acid; 303-38-8; C00196

2,3-Dihydroxybenzoate;2,3-Dihydroxybenzoic acid;2-Pyrocatechuate;2-Pyrocatechuic acid;3-Hydroxysalicylate;3-Hydroxysalicylic acid;Catecholcarboxylate;Catecholcarboxylic acid;DHBA;DOBK;O-Pyrocatechuate;O-Pyrocatechuic acid;Pyrocatechuate;Pyrocatechuic acid

2,3-Dihydroxybenzoic acid sodium salt; 3-Hydroxysalicylic acid sodium salt; Benzoic acid, 2,3-dihydroxy-, sodium salt; Catechlolcarboxylic acid sodium salt; LS-136479; Pyrocatechuic acid sodium salt; o-Pyrocatechuic acid, sodium salt

2,3-Dihydroxybenzoic Acid [303-38-8]; (Catechol-3-carboxylic acid)

2,3-Dihydroxybenzoic acid, 98%

2,3-Dihydroxybenzoic acid, 99%

2,3-DIHYDROXYBENZOIC ACID; [303-38-8]

2,3-Dihydroxybenzoicacid

2-Pyrocatechuic acid

CHEBI:41901; CHEBI:885; CHEBI:19320

MFCD00002446

OR-0490

PYROCATECHUIC ACID

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.17 0.8 -51.54 2 4 -1 81 153.113 1

Vendor Notes

Note Type Comments Provided By
MP 203.3-204.7o C Indofine
MP 204 - 206 Enamine Building Blocks
Mp [°C] 204 - 208 Acros Organics
MP 204-206 °C(lit.) Indofine
Melting_Point 204-208? Alfa-Aesar
Melting_Point 204-208° Alfa-Aesar
MP 204...206 Enamine Building Blocks
MP 205 TCI
MP 206-208° Oakwood Chemical
UniProt Database Links 3HBCL_THAAR; AMOA_AERHY; CBACL_PSEUC; DBD23_ASPNG; DBD23_ASPOR; ENTB_ECO57; ENTB_ECOLI; ENTB_SHIFL; ENTE_ECO57; ENTE_ECOLI; ENTF_ECO57; ENTF_ECOLI; ENTF_SHIFL; ENTH_ECOLI; ICS_CATRO ChEBI
ALOGPS_SOLUBILITY 6.88e+00 g/l DrugBank-experimental
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Purity 97% APIChem
Purity 98% Fluorochem
therap antioxidant MicroSource Spectrum
H phrase H315: Causes skin irritation Acros Organics
H phrase H315: Causes skin irritation; H319: Causes serious eye irritation; H335: May cause respiratory irritation Acros Organics
P phrase P261: Avoid breathing dust/fume/gas/mist/vapors/spray Acros Organics
P phrase P261: Avoid breathing dust/fume/gas/mist/vapors/spray; P302+ P352: IF ON SKIN: Wash with plenty of soap and water; P280: Wear protective gloves/protective clothing/eye protection/face protection; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water Acros Organics
R phrase R36/37/38: Irritating to eyes, respiratory system and skin. Acros Organics
S phrase S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. Acros Organics
S phrase S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.; S37/39: Wear suitable gloves and eye/face protection. Acros Organics
Patent Database Links US2005137162; US2007010579; US2007178123; US2007191368 ChEBI
Hazard XI: Irritant Acros Organics

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