Basic information
- CAS
97528-24-0- Standard SMILES
Cc1ccc(NC(=O)C(C)(C)C)c(C)c1- InChIKey
UNNKNOWVLKOZRO-UHFFFAOYSA-N- Molecular formula
- C13H19NO
- Average molar mass
- 205.3 g/mol
- Monoisotopic mass
- 205.14666423
Names & identifiers
- Preferred name
- N-(2,4-Dimethylphenyl)-2,2-dimethylpropanamide
- IUPAC
- N-(2,4-dimethylphenyl)-2,2-dimethylpropanamide
- English name
- N-(2,4-Dimethylphenyl)pivalamide
- Molecular formula
- C13H19NO
- Molecular weight
- 205.3
Names & synonyms
N-(2,4-dimethylphenyl)-2,2-dimethylpropanamideRefChem:823984665-542-8N-(2,4-Dimethylphenyl)pivalamide97528-24-0MFCD00459292JHICC03006CCG-862DTXSID10351313AKOS000528476BS-23656DB-308460
Show more names
2',4'-dimethylpivalanilidePropanamide, N-(2,4-dimethylphenyl)-2,2-dimethyl-
CS-0207306G63923N-(2,4-dimethylphenyl)-2,2-dimethyl-propanamideZ27801608
Database identifiers
- CAS
97528-24-0- PubChem CID
- 697223
- DTXSID
DTXSID10351313- EC Number
- 665-542-8
- Nikkaji
- J2.880.074F
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 229
Physicochemical properties
- Melting point
- 111.5 °C · 111.5 °C
- Boiling point
- 328.8 · 328.8±11.0 °C(Predicted)
- Density
- 1.003 · 1.003±0.06 g/cm3(Predicted)
- pka
- 15.14 · 15.14±0.70(Predicted)
- Symbol(GHS)
- 7 · GHS07,GHS05
- Signal word
- Danger
- Hazard statements
- 335 · H335-H318-H315
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P280-P305+P351+P338-P310
Safety & regulation
GHS classification
GHS Classification
Danger
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS07,GHS05
- Hazard statements
- H335-H318-H315
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P280-P305+P351+P338-P310
Chemistry & industry
Suppliers12 total
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Aladdin Scientific[email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
上海贤鼎生物科技有限公司4009209199 · [email protected]
郑州康弗辰医药科技有限公司18210788515; 18210788515 · [email protected]
武汉凯威斯科技有限公司027-67849912 · [email protected]
常州千艾生物科技有限公司051915240519135 13961152745 · [email protected]
武汉凯威斯科技有限公司027-67849912 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [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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