N-(4-methyl-5-nitropyridin-2-yl)acetamide

HCID 13567013CAS 90765-02-9
Substructure searchFind similar structures

Basic information

Standard SMILES
CC(=O)Nc1cc(C)c([N+](=O)[O-])cn1
InChIKey
RXLYNDDWAMZCDD-UHFFFAOYSA-N
Molecular formula
C8H9N3O3
Average molar mass
195.18 g/mol
Monoisotopic mass
195.06439115

Names & identifiers

Preferred name
N-(4-methyl-5-nitropyridin-2-yl)acetamide
IUPAC
N-(4-methyl-5-nitro-2-pyridinyl)acetamide
English name
2-Acetamido-5-nitro-4-picoline
Molecular formula
C8H9N3O3
Molecular weight
195.18

Names & synonyms

90765-02-9N-(4-methyl-5-nitropyridin-2-yl)acetamide2-Acetamido-5-nitro-4-picolineN-(4-Methyl-5-nitro-2-pyridyl)acetamideMFCD056624022-Acetamido-4-Methyl-5-Nitropyridine2-Acetylamino-4-methyl-5-nitropyridineN-(4-methyl-5-nitropyridin-2-yl) acetamideSCHEMBL2019522SCHEMBL29643004DTXSID60543988RXLYNDDWAMZCDD-UHFFFAOYSA-N
Show more names
2-Acetamido-5-nitro-picoline4-Picoline,2-acetamido-5-nitro- (7CI)N-(4-Methyl-5-nitro-2-pyridinyl)-acetamideAcetamide, N-(4-methyl-5-nitro-2-pyridinyl)-2-ACETAMIDO-5-NITRO-4-PICOLINE ISO 9001：2015 REACH
AC7197AKOS006237406SY041197N1-(4-Methyl-5-nitro-2-pyridyl)acetamideCS-0367866N-(4-Methyl-5-nitro-pyridin-2-yl)-acetamideF757603

Database identifiers

CAS
90765-02-9
PubChem CID
13567013
DTXSID
DTXSID60543988

Properties

Computed structural properties

XLogP
0.6
Topological polar surface area
87.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
1
Heavy atoms
14

Physicochemical properties

Melting point
157 ℃ · 157℃
Boiling point
421.5 · 421.5±45.0 °C(Predicted)
Density
1.356 · 1.356±0.06 g/cm3(Predicted)
pka
12.61 · 12.61±0.70(Predicted)
HS Code
2933399990 · 2933399990

Safety & regulation

Safety data

hs_code
2933399990

Chemistry & industry

Upstream & downstream products

Suppliers17 total

Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
陕西缔都化学有限公司029-029-81123119 17391733320 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]

Related reactions

14 records
New reaction record

Linked notes

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