Basic information
- Standard SMILES
Nc1ccc2n[nH]cc2c1- InChIKey
XBTOSRUBOXQWBO-UHFFFAOYSA-N- Molecular formula
- C7H7N3
- Average molar mass
- 133.15 g/mol
Names & identifiers
- Preferred name
- 1H-Indazol-5-amine
- IUPAC
- 1H-indazol-5-amine
- English name
- 2H-Indazol-5-amine
- Molecular formula
- C7H7N3
- Molecular weight
- 133.15
Names & synonyms
5-Aminoindazole1H-Indazol-5-amine19335-11-65-Amino-1H-indazole1H-Indazole, 5-amino-A5B06TDT72NSC-44676DTXSID2066480AC-30454RefChem:101992DTXCID9036060242-971-5
Show more names
2H-indoleazole-5-amine
2H-Indazol-5-amine918903-42-11H-Indazol-5-ylamine5-AMINOBENZOPYRAZOLEMFCD000379755-Amino-indazole1~{h}-Indazol-5-AmineCHEMBL17551
Database identifiers
- CAS
918903-42-1- ChEMBL
CHEMBL17551- UNII
- A5B06TDT72
- EC Number
- 242-971-5
- Nikkaji
- J40.998G
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 54.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 126
Experimental & physicochemical properties
LogP0.65
Solubility17.9 [ug/mL] (The mean of the results at pH 7.4)
Physicochemical properties
- Boiling point
- 204.3 · 204.3±23.0 °C(Predicted)
- Density
- 1.367 · 1.367±0.06 g/cm3(Predicted)
- pka
- 15.63 · 15.63±0.30(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
GHS classification
GHS Classification
Danger
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P316, 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 49 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory Information1H-Indazol-5-amine: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesAcute Tox. 3 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1H-Indazol-5-amine: INACTIVE
Suppliers11 total
郑州汇聚化工有限公司0371-53399770 18037166334 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
上海毕得医药科技股份有限公司400-164-7117 18317119277 · [email protected]
天津正泽兴科技有限公司199-2257-5710 13116104906 · [email protected]
华诺医药科技(广西)有限公司13005928603 · [email protected]
上海玉函化工有限公司021-61469567 13774476675 · [email protected]
上海腾骞生物科技有限公司021-50895067 18616507272;13681616114;15020344067 · [email protected]
常州安赛普化工有限公司0519-86305871 · [email protected]
上海研邦医药科技有限公司15618536883 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Linked notes
Loading…