Benzamide, 4-(1-methylethyl)-

HCID 69277
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Basic information

CAS
619-76-1
Standard SMILES
CC(C)c1ccc(C(N)=O)cc1
InChIKey
JFYDEFSWRWLDGE-UHFFFAOYSA-N
Molecular formula
C10H13NO
Average molar mass
163.22 g/mol
Monoisotopic mass
163.09971404

Names & identifiers

Preferred name
Benzamide, 4-(1-methylethyl)-
IUPAC
4-propan-2-ylbenzamide
English name
Benzamide, 4-(1-methylethyl)- (9CI)
Molecular formula
C10H13NO
Molecular weight
163.22

Names & synonyms

Benzamide, 4-(1-methylethyl)-4-(1-Methylethyl)benzamideDTXSID90210934RefChem:117125DTXCID20133425JFYDEFSWRWLDGE-UHFFFAOYSA-N4-Isopropylbenzamide619-76-14-propan-2-ylbenzamide4-(propan-2-yl)benzamideMFCD09418499BENZAMIDE, 4-(1-METHYLETHYL)- (9CI)
Show more names
4-Cumenecarboxamide
Benzamide,4-(1-methylethyl)-4-isopropyl benzamide4-Isopropyl-benzamide4-Isopropylbenzamide #4-(methylethyl)benzamideSCHEMBL84429SCHEMBL3091381CHEMBL3247925

Database identifiers

CAS
619-76-1
PubChem CID
69277
DTXSID
DTXSID90210934
ChEMBL
CHEMBL3247925
Nikkaji
J126.577F

Properties

Computed structural properties

XLogP
2.1
Topological polar surface area
43.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
2
Heavy atoms
12

Experimental & physicochemical properties

LogP2.14

Physicochemical properties

Melting point
153 °C · 153 °C
Boiling point
282.1 · 282.1±19.0 °C(Predicted)
Density
1.031 · 1.031±0.06 g/cm3(Predicted)
pka
16.19 · 16.19±0.50(Predicted)
Symbol(GHS)
7 · GHS07
Signal word
Warning

Safety & regulation

Safety data

hs_code
2924297099
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P280-P305+P351+P338

Chemistry & industry

Suppliers8 total

阳谷荣科商贸有限公司15863541132 · [email protected]
陕西缔都医药化工有限公司+86-29-87569262 +86-15003564040 · [email protected]
菏泽星达医药科技有限公司13583079096 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 400-867-5858;400-867-5858 · [email protected]
山东煜昌药业有限公司531-87153728 13805401165 · [email protected]

Related reactions

18 records
New reaction record

Compound notes

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