Basic information
- CAS
64037-15-6- Standard SMILES
Cc1ccc2oc(N)nc2c1- InChIKey
JIWCNPTXYLRLIE-UHFFFAOYSA-N- Molecular formula
- C8H8N2O
- Average molar mass
- 148.16 g/mol
- Monoisotopic mass
- 148.06366288
Names & identifiers
- Preferred name
- Benzoxazole, 2-amino-5-methyl-
- IUPAC
- 5-methyl-1,3-benzoxazol-2-amine
- English name
- 5-Methylbenzoxazole-2-amine
- Molecular formula
- C8H8N2O
- Molecular weight
- 148.16
Names & synonyms
64037-15-6BENZOXAZOLE, 2-AMINO-5-METHYL-DTXSID30214037RefChem:1079372DTXCID301365285-Methyl-2-aminobenzoxazol5-methyl-1,3-benzoxazol-2-amine5-Methylbenzoxazole-2-amine5-Methyl-benzooxazol-2-ylamine5-methylbenzo[d]oxazol-2-amine2-Benzoxazolamine, 5-methyl-2-Amino-5-methylbenzoxazole
Show more names
MFCD016641455-METHYL-2-BENZOXAZOLAMINE5-methylbenzoxazole-2-ylamineNSC24990Oprea1_034399SCHEMBL12261SCHEMBL7352384SCHEMBL31119200
Database identifiers
- CAS
64037-15-6- PubChem CID
- 46388
- DTXSID
DTXSID30214037- Nikkaji
- J67.897J
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 52.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 151
Physicochemical properties
- Melting point
- 125 · 125-131 °C
- Boiling point
- 268.75 °C · 268.75°C (rough estimate)
- Density
- 1.1828 · 1.1828 (rough estimate)
- refractive index
- 1.6 · 1.6000 (estimate)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2–8 °C
- form
- solid
- pka
- 4.24 · 4.24±0.10(Predicted)
- color
- Red
- EWG's Food Scores
- 1 · 1
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
- HS Code
- 2934999090 · 2934999090
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
- hs_code
- 2934999090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319
- Precautionary statements
- P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
Chemistry & industry
Suppliers36 total
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]
郑州汇聚化工有限公司13393710386 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [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]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
韶远科技（上海）有限公司4000665055 · [email protected]
Zhejiang J&C Biological Technology Co.,Limited+1-2135480471 · [email protected]
杭州东帆化学有限公司86-0571-85151182
济南千叶医药技术有限公司0531-81313138 13066006660 · [email protected]
台州南峰药物研究所[email protected] 13127117265 · [email protected]
赛纳斯特化学（欢迎点击联系）021-60343070
上海安米克化学品有限公司微信 18019252918 18019252918 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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