Basic information
- CAS
1569-08-0- Standard SMILES
CC1(C)COC(Cc2ccccc2)=N1- InChIKey
GPBCTHQIXXYBHQ-UHFFFAOYSA-N- Molecular formula
- C12H15NO
- Average molar mass
- 189.25 g/mol
- Monoisotopic mass
- 189.1153641
Names & identifiers
- Preferred name
- 4,4-Dimethyl-2-phenylmethyl-2-oxazoline
- IUPAC
- 2-benzyl-4,4-dimethyl-5H-1,3-oxazole
- English name
- 2-BENZYL-4,4-DIMETHYL-4,5-DIHYDRO-1,3-OXAZOLE
- Molecular formula
- C12H15NO
- Molecular weight
- 189.25
Names & synonyms
1569-08-02-Benzyl-4,4-dimethyl-2-oxazolineOxazole, 4,5-dihydro-4,4-dimethyl-2-(phenylmethyl)-NSC 160542W7J28W8W2YP-1890NSC-1605424,4-Dimethyl-2-(phenylmethyl)-4,5-dihydrooxazoleUNII-W7J28W8W2Y4,4-Dimethyl-2-phenylmethyl-2-oxazolineDTXSID001661552-OXAZOLINE, 2-BENZYL-4,4-DIMETHYL-
Show more names
2-(benzyl)-4,4-dimethyl-5H-oxazole4,4-dimethyl-2-(phenylmethyl)-5H-1,3-oxazole4,5-dihydro-4,4-dimethyl-2-(phenylmethyl)-oxazol
4,5-DIHYDRO-4,4-DIMETHYL-2-(PHENYLMETHYL)OXAZOLERefChem:198485DTXCID80886462-Benzyl-4,4-dimethyl-4,5-dihydrooxazole2-Benzyl-4,4-dimethyl-4,5-dihydro-1,3-oxazole2-benzyl-4,4-dimethyl-5H-1,3-oxazoleMFCD00102140NSC160542
Database identifiers
- CAS
1569-08-0- PubChem CID
- 98710
- DTXSID
DTXSID00166155- ChEMBL
CHEMBL2138529- UNII
- W7J28W8W2Y
- EC Number
- 677-796-7
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 21.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 226
Physicochemical properties
- storage temp.
- 2 · 2-8°C
- CAS DataBase Reference
- 1569 · 1569-08-0
- FDA UNII
- 7 J28W8W2Y · W7J28W8W2Y
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 264 · P264-P270-P301+P312a-P330-P501a
- Risk Statements
- 36 · 36
- Safety Statements
- 24 · 24/25-26
- RTECS
- 6798960 · RP6798960
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]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 4 reports by companies from 1 notifications to the ECHA C&L Inventory.
Safety data
- rtecs
- RP6798960
- risk_code
- 36
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 24/25-26
- Hazard statements
- H302
- Precautionary statements
- P264-P270-P301+P312a-P330-P501a
Chemistry & industry
Suppliers8 total
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
上海渤腾医药科技有限公司13524892556 · [email protected]
上海奈亦斯生物科技有限公司18321139117 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
1 records
Compound notes
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