Basic information
- CAS
15540-79-1- Standard SMILES
Nc1cc(O)c(C(=O)O)cc1C(=O)O- InChIKey
BLBBHFYLFBKYNA-UHFFFAOYSA-N- Molecular formula
- C8H7NO5
- Average molar mass
- 197.14 g/mol
- Monoisotopic mass
- 197.03242232
Names & identifiers
- Preferred name
- 4-Amino-6-hydroxybenzene-1,3-dicarboxylic acid
- IUPAC
- 4-amino-6-hydroxybenzene-1,3-dicarboxylic acid
- English name
- 4-amino-6-hydroxybenzene-1,3-dicarboxylic acid
- Molecular formula
- C8H7NO5
- Molecular weight
- 197.14
Names & synonyms
15540-79-14-amino-6-hydroxybenzene-1,3-dicarboxylic acidRefChem:518005891-994-24-Amino-6-hydroxyisophthalic acid4-Amino-6-hydroxy-1,3-benzenedicarboxylic AcidMFCD20638466Acetylsalicylic Acid Impurity 8Sodium aminosalicylate Impurity 54-amino-6-hydroxy-benzene-1,3-dicarboxylic acidAspirin Impurity 3Acetylsalicylic Acid Impurity 3
Show more names
U4O-1001012-05Acety alicylic Acid Impurity 8Acety alicylic Acid Impurity 101,3-Benzenedicarboxylic acid, 4-amino-6-hydroxy-
4-Amino-6-hydroxy isophthalic acidorb3215432SCHEMBL29214415QAA54079AKOS022645532SY1730154-amino-6-hydroxybenzene-1,3-dicarboxylicacidEN300-199121
Database identifiers
- CAS
15540-79-1- PubChem CID
- 459347
- EC Number
- 891-994-2
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 121 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 254
Physicochemical properties
- Melting point
- 212 °C · 212 °C (decomp)
- Boiling point
- 492 · 492.0±45.0 °C(Predicted)
- Density
- 1.711 · 1.711±0.06 g/cm3(Predicted)
- solubility
- DMSO (Slightly), Methanol (Slightly)
- pka
- 3.11 · 3.11±0.10(Predicted)
- form
- Solid
- color
- Pale Yellow to Pale Beige
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H312-H332
- Precautionary statements
- 261 · P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P330-P362-P403+P233-P501
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H312-H332
- Precautionary statements
- P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P330-P362-P403+P233-P501
Chemistry & industry
Applications
Uses4-Amino-6-hydroxy-1,3-benzenedicarboxylic Acid is a compound with tuberculostatic activity. It also has antimalarial acitvity.
Suppliers30 total
济南百隆化学有限公司[email protected] · [email protected]
广州佳途科技股份有限公司81960175-877 18933936954 · [email protected]
广州隽唐科技有限公司020-36607679 13502246435 · [email protected]
Sinco Pharmachem (ShenZhen) R&D Co., Ltd.+86-18603013401 · [email protected]
上海柯维化学技术有限公司021-64609169 18901607656 · [email protected]
吉林中科研伸科技有限公司18143011203 · [email protected]
南京芊亿达新材料科技有限公司15384069853 · [email protected]
杭州云易国科生物科技有限公司18457506494 · [email protected]
深圳振强药物研发有限公司0755-66853366 13670046396 · [email protected]
深圳菲斯生物科技有限公司0755-83725350 13380397412 · [email protected]
常州翔龙医药科技有限公司18915873328 18915873328 · [email protected]
TLC梯尔希（南京）药物研发有限公司18012923235 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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