Basic information
- CAS
2066-89-9- Standard SMILES
NNC(=O)c1ccncc1.Nc1ccc(C(=O)O)c(O)c1- InChIKey
RKPHTRVPGYGVQD-UHFFFAOYSA-N- Molecular formula
- C13H14N4O4
- Average molar mass
- 290.27 g/mol
- Monoisotopic mass
- 290.10150494
Names & identifiers
- Preferred name
- Pasiniazid
- IUPAC
- 4-amino-2-hydroxybenzoic acid;pyridine-4-carbohydrazide
- English name
- Pasiniazid
- Molecular formula
- C13H14N4O4
- Molecular weight
- 290.27
Names & synonyms
Pasiniazid2066-89-9PasiniazideIsoniazid 4-aminosalicylateRD 328DIPASICFINTOZIDNIDRAPASPASCIDABERPASHAIN83J17CN0MNNSC-758447
Show more names
ParaniazidePasiniazid USP/EP/BPPasiniazid (Standard)IsoniazidAminosalicylate
GEWO-399DTXSID50174700RD-328RefChem:170141isoniazide 4-aminosalicylateDTXCID7097191218-183-2Pasiniazid [INN:DCF]
Database identifiers
- CAS
2066-89-9- PubChem CID
- 16367
- DTXSID
DTXSID50174700- ChEMBL
CHEMBL1496806- UNII
- 83J17CN0MN
- EC Number
- 218-183-2
Properties
Computed structural properties
- Topological polar surface area
- 152 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 280
Physicochemical properties
- Melting point
- 142 · 142-144°
- storage temp.
- Keep in dark place,Inert atmosphere,Room temperature
- solubility
- Water
- form
- Solid
- color
- Light yellow to khaki
- Major Application
- forensics and toxicologypharmaceutical (small molecule)
- InChI
- InChI=1S/C7H7NO3.C6H7N3O/c8-4-1-2-5(7(10)11)6(9)3-4;7-9-6(10)5-1-3-8-4-2-5/h1-3,9H,8H2,(H,10,11);1-4H,7H2,(H,9,10)
- InChIKey
- RKPHTRVPGYGVQD-UHFFFAOYSA-N
- SMILES
- C1(C(=O)O)C=CC(N)=CC=1O.C1(C(=O)NN)=CC=NC=C1
- FDA UNII
- 83 J17CN0MN · 83J17CN0MN
- UNSPSC Code
- 41116107 · 41116107
- NACRES
- 24 · NA.24
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P264-P270-P301+P312-P302+P352-P305+P351+P338
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)
Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- PPE
- dust mask type N95 (US), Eyeshields, Gloves
- wgk
- 3
- risk_code
- 22-36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xn,Xi
- safety_code
- 26-36/37
- Storage Class
- 11 - Combustible Solids
- target organs
- Respiratory system
- Hazard statements
- H302-H315-H319-H335
- Hazard Classifications
- Acute Tox. 4 OralEye Irrit. 2Skin Irrit. 2STOT SE 3
- Precautionary statements
- P261-P264-P270-P301+P312-P302+P352-P305+P351+P338
Chemistry & industry
Applications
Usesantibacterial (tuberculostatic)
UsesPasiniazid is an antituberculous agents against several species of rapidly growing mycobacteria (RGM).
Upstream & downstream products
Upstream raw materials
Suppliers61 total
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
成都彼样生物科技有限公司18108052721 · [email protected]
河南赢创生物科技有限公司16650615803 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
河北枫嘉新材料科技有限公司+86-0311-87836622 +86-18712993135 · [email protected]
Aladdin Scientific[email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
United Life Science020-82099279 18988968278 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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