4-Chloro-N,N-diisopropylpicolinamide

HCID 11299458
NotesReactions
Substructure searchFind similar structures

Basic information

CAS
168428-76-0
Standard SMILES
CC(C)N(C(=O)c1cc(Cl)ccn1)C(C)C
InChIKey
VMNWYVODDVOFPF-UHFFFAOYSA-N
Molecular formula
C12H17ClN2O
Average molar mass
240.73 g/mol
Monoisotopic mass
240.10294084

Names & identifiers

Preferred name
4-Chloro-N,N-diisopropylpicolinamide
IUPAC
4-chloro-N,N-di(propan-2-yl)pyridine-2-carboxamide
English name
4-Chloro-N-diisopropyl-pyridine-2-carboxamide
Molecular formula
C12H17ClN2O
Molecular weight
240.73

Names & synonyms

4-Chloro-N,N-diisopropylpicolinamide168428-76-04-chloro-N,N-di(propan-2-yl)pyridine-2-carboxamide4-Chloro-N-diisopropyl-pyridine-2-carboxamideMFCD087056784-chloro-N,N-diisopropylpyridine-2-carboxamideA810972SCHEMBL712142SCHEMBL30726837SCHEMBL30726838DTXSID80461655VMNWYVODDVOFPF-UHFFFAOYSA-N
Show more names
4-chloro-N,N-bis(propan-2-yl)pyridine-2-carboxaMide
AKOS015848859DB-0815884-chloro-N,N-diisopropyl-pyridine-2-carboxamide4-Chloro-N,N-diisopropylpicolinamide, AldrichCPR4-chloro-N,N-di(propan-2-yl)-2-pyridinecarboxamide4-chloranyl-N,N-di(propan-2-yl)pyridine-2-carboxamide2-Pyridinecarboxamide, 4-chloro-N,N-bis(1-methylethyl)-

Database identifiers

CAS
168428-76-0
PubChem CID
11299458
DTXSID
DTXSID80461655
Nikkaji
J1.772.766D

Properties

Computed structural properties

XLogP
2.9
Topological polar surface area
33.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
16

Physicochemical properties

Boiling point
361.3 · 361.3±27.0 °C(Predicted)
Density
1 · 1+-.0.06 g/cm3(Predicted)
pka
0.72 · 0.72±0.10(Predicted)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302

Safety & regulation

Safety data

wgk
3
risk_code
22
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xi,Xn
hazard_class
IRRITANT

Chemistry & industry

Suppliers11 total

Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Aladdin Scientific[email protected]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]

Related reactions

2 records
New reaction record

Compound notes

Loading…