Basic information
- CAS
74356-30-2- Standard SMILES
Cc1noc(C)c1C(N)=O- InChIKey
GHJOYRMAYLLOIO-UHFFFAOYSA-N- Molecular formula
- C6H8N2O2
- Average molar mass
- 140.14 g/mol
- Monoisotopic mass
- 140.0585775
Names & identifiers
- Preferred name
- 3,5-Dimethylisoxazole-4-carboxamide
- IUPAC
- 3,5-dimethyl-1,2-oxazole-4-carboxamide
- English name
- 3,5-Dimethyl-4-isoxazolecarboxamide
- Molecular formula
- C6H8N2O2
- Molecular weight
- 140.14
Names & synonyms
3,5-Dimethylisoxazole-4-carboxamide74356-30-2DTXSID30353031RefChem:271965DTXCID403040943,5-dimethyl-4-isoxazolecarboxamide3,5-dimethyl-1,2-oxazole-4-carboxamidedimethyl-1,2-oxazole-4-carboxamideMFCD026819733,5-DIMETHYLI-4-ISOXAZOLECARBOXAMIDE4-isoxazolecarboxamide, 3,5-dimethyl-SCHEMBL352276
Show more names
BUTTPARK 145\12-734-Isoxazolecarboxamide,3,5-dimethyl-(7CI,9CI)3,5-Dimethyl-isoxazole-4-carboxylic acid amide
SCHEMBL3643406GHJOYRMAYLLOIO-UHFFFAOYSA-NSBB086139AKOS006228953CS-0326481AR-360/40631387F386848
Database identifiers
- CAS
74356-30-2- PubChem CID
- 736478
- DTXSID
DTXSID30353031- EC Number
- 881-318-4
- Nikkaji
- J2.865.230E
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 69.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 149
Physicochemical properties
- Melting point
- 148 °C · 148 °C
- Boiling point
- 246.319 · 246.319±40.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.201 · 1.201±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 14.459 · 14.459±0.50(predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P271-P280
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36/37/39
- Hazard Note
- Irritant
- 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
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_note
- Irritant
- safety_code
- 26-36/37/39
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P271-P280
Chemistry & industry
Suppliers12 total
郑州汇聚化工有限公司13393710386 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
赛默飞世尔科技（中国）有限公司800-810-5118 · [email protected]
阳谷荣科商贸有限公司15863541132 · [email protected]
九鼎化学（上海）科技有限公司4009209199 · [email protected]
济南荣科药业有限公司18615606162 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
career henan chemical co+86-0371-86658258 · [email protected]
山东煜昌药业有限公司531-87153728 13805401165 · [email protected]
重庆卡兰医药有限公司[email protected]
Hefei TNJ Chemical Industry Co.,Ltd.+86-0551-65418684 +86-18949823763 · [email protected]
陕西缔都化学有限公司17691182729 17392216275 · [email protected]
Related reactions
1 records
Compound notes
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