N-Pyridin-4-ylacetamide

HCID 21288
NotesReactions
Substructure searchFind similar structures

Basic information

CAS
5221-42-1
Standard SMILES
CC(=O)Nc1ccncc1
InChIKey
BIJAWQUBRNHZGE-UHFFFAOYSA-N
Molecular formula
C7H8N2O
Average molar mass
136.15 g/mol
Monoisotopic mass
136.06366288

Names & identifiers

Preferred name
N-Pyridin-4-ylacetamide
IUPAC
N-pyridin-4-ylacetamide
English name
4-Acetamidopyridine
Molecular formula
C7H8N2O
Molecular weight
136.15

Names & synonyms

N-Pyridin-4-ylacetamideN-4-PyridinylacetamideRefChem:831075226-018-04-AcetamidopyridineN-(pyridin-4-yl)acetamide5221-42-14-AcetylaminopyridineAcetamide, N-4-pyridinyl-Pyridine, 4-acetamido-N-(4-Pyridyl)acetamidePhillips 2038
Show more names
AKOS 93468phillips2038n-4-pyridinyl-acetamidn-(4-pyridyl)-acetamid4-Acetamidopyridine >
MFCD007201264-(Acetylamino)pyridineBRN 0113907EINECS 226-018-0Acetamide, N-4-pyridinyl- (9CI)ACETAMIDE, N-(4-PYRIDYL)-DTXSID30200258STK050992

Database identifiers

CAS
5221-42-1
PubChem CID
21288
DTXSID
DTXSID30200258
ChEMBL
CHEMBL11959
EC Number
226-018-0
Nikkaji
J31.400E

Properties

Computed structural properties

XLogP
0.5
Topological polar surface area
42 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
10

Experimental & physicochemical properties

LogP0.5

Physicochemical properties

Melting point
152 °C · 152 °C
Boiling point
250.42 °C · 250.42°C (rough estimate)
Density
1.1778 · 1.1778 (rough estimate)
refractive index
1.566 · 1.5660 (estimate)
storage temp.
Inert atmosphere,Room Temperature
solubility
soluble in Methanol

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Safety data

rtecs
AC7875000
hs_code
2933.39.9200
Toxicity
LD50 orl-rat: 446 mg/kg TXAPA9 21,315,72
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302

Chemistry & industry

Upstream & downstream products

Suppliers56 total

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]

Related reactions

12 records
New reaction record

Compound notes

Loading…