Basic information
- CAS
61382-21-6- Standard SMILES
Nc1ccc2oc(-c3cccnc3)nc2c1- InChIKey
ITFJBVWVZSRNHZ-UHFFFAOYSA-N- Molecular formula
- C12H9N3O
- Average molar mass
- 211.22 g/mol
- Monoisotopic mass
- 211.07456192
Names & identifiers
- Preferred name
- 2-Pyridin-3-yl-benzooxazol-5-ylamine
- IUPAC
- 2-pyridin-3-yl-1,3-benzoxazol-5-amine
- English name
- 2-pyridin-3-yl-1,3-benzoxazol-5-amine
- Molecular formula
- C12H9N3O
- Molecular weight
- 211.22
Names & synonyms
61382-21-62-Pyridin-3-yl-benzooxazol-5-ylamineDTXSID30352903RefChem:266534DTXCID003039672-(pyridin-3-yl)-1,3-benzoxazol-5-amine2-(pyridin-3-yl)benzo[d]oxazol-5-amine2-pyridin-3-yl-1,3-benzoxazol-5-amineMFCD004479142-(3-pyridyl)-1,3-benzoxazol-5-amine2-pyridin-3-yl-1,3-benzoxazol-5-ylamineSCHEMBL1361829
Show more names
[2-(3-pyridyl)-1,3-benzoxazol-5-yl]amine
CHEMBL4800407SCHEMBL30402176ALBB-0061632-(3-pyridyl)benzoxazole-5-ylamineSTK021142AKOS0001083872-(3-Pyridyl)benzo[d]oxazol-5-amine5-Benzoxazolamine, 2-(3-pyridinyl)-
Database identifiers
- CAS
61382-21-6- PubChem CID
- 736008
- DTXSID
DTXSID30352903- ChEMBL
CHEMBL4800407- Nikkaji
- J608.411G
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 64.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 248
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07,GHS08
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H341
- Precautionary statements
- 501 · P501-P270-P202-P201-P264-P280-P302+P352-P308+P313-P337+P313-P305+P351+P338-P362+P364-P332+P313-P301+P312+P330-P405
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07,GHS08
- Hazard statements
- H302-H315-H319-H341
- Precautionary statements
- P501-P270-P202-P201-P264-P280-P302+P352-P308+P313-P337+P313-P305+P351+P338-P362+P364-P332+P313-P301+P312+P330-P405
Chemistry & industry
Suppliers15 total
陕西格列弗生物科技研究有限责任公司18409274651; 13892423764 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]
焦作沃恩生物科技有限责任公司0391-3702345 18739121806 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
上海创焰化学科技有限公司021-11111111 11111111111 · [email protected]
上海鑫圭生物科技有限公司15121041756 · [email protected]
河南威梯希化工科技有限公司0371-53732842 13383863444 · [email protected]
华诺医药科技(广西)有限公司13005928603 · [email protected]
上海康恩博医药科技有限公司（科小研试剂）400-1388-521 17510465506 · [email protected]
Shanghai Daken Advanced Materials Co.,Ltd+86-2158073036 · [email protected]
砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
合肥钼凯医药科技有限公司18001872185; 18001872185 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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