N-(2-Methyl-5-nitrophenyl)acetamide

HCID 76144
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Basic information

CAS
2879-79-0
Standard SMILES
CC(=O)Nc1cc([N+](=O)[O-])ccc1C
InChIKey
YMHUULKGTGEHHQ-UHFFFAOYSA-N
Molecular formula
C9H10N2O3
Average molar mass
194.19 g/mol
Monoisotopic mass
194.06914219

Names & identifiers

Preferred name
N-(2-Methyl-5-nitrophenyl)acetamide
IUPAC
N-(2-methyl-5-nitrophenyl)acetamide
English name
N-(2-Methyl-5-nitrophenyl)acetamide
Molecular formula
C9H10N2O3
Molecular weight
194.19

Names & synonyms

N-(2-Methyl-5-nitrophenyl)acetamide2879-79-0Acetamide, N-(2-methyl-5-nitrophenyl)-2-Acetylamino-4-nitrotolueneo-Acetotoluidide, 5'-nitro-MFCD000247705'-Nitro-ortho-acetotoluidide2-Acetamido-4-nitrotolueneN-(2-Methyl-5-nitro-phenyl)-acetamide2-Methyl-5-nitroacetanilideNSC33950EINECS 220-727-9
Show more names
NSC 33950Acetamide,N-(2-methyl-5-nitrophenyl)-AI3-28292Maybridge1_0002952-Acetamino-4-nitrotoluol4-Nitro-2-acetamidotolueneOprea1_602888SCHEMBL427418

Database identifiers

CAS
2879-79-0
PubChem CID
76144
DTXSID
DTXSID80182974
EC Number
220-727-9
Nikkaji
J306.802A

Properties

Computed structural properties

XLogP
1.1
Topological polar surface area
74.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
14

Physicochemical properties

Melting point
150 · 150-151 °C(Solv: ethanol (64-17-5))
Boiling point
374.4 · 374.4±30.0 °C(Predicted)
Density
1.289 · 1.289±0.06 g/cm3(Predicted)
pka
14.21 · 14.21±0.70(Predicted)

Chemistry & industry

Upstream & downstream products

Downstream products

Suppliers10 total

江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
上海修时生物医药有限公司15002184385 15021598081 15002184385 · [email protected]
合肥钼凯医药科技有限公司18130062233 · [email protected]

Related reactions

2 records
New reaction record

Compound notes

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