5-Bromo-N-cyclopropylpyridine-2-carboxamide

HCID 26370089CAS 638219-77-9
Substructure searchFind similar structures

Basic information

Standard SMILES
O=C(NC1CC1)c1ccc(Br)cn1
InChIKey
MBQYBUFHINSBNB-UHFFFAOYSA-N
Molecular formula
C9H9BrN2O
Average molar mass
241.08 g/mol
Monoisotopic mass
239.98982501

Names & identifiers

Preferred name
5-Bromo-N-cyclopropylpyridine-2-carboxamide
IUPAC
5-bromo-N-cyclopropylpyridine-2-carboxamide
English name
5-Bromo-N-cyclopropylpyridine-2-carboxamide
Molecular formula
C9H9BrN2O
Molecular weight
241.08

Names & synonyms

638219-77-95-Bromo-N-cyclopropylpicolinamide5-Bromo-N-cyclopropylpyridine-2-carboxamideN-Cyclopropyl 5-bromopicolinamide5-Bromo-N-cyclopyridine-2-carboxamideMFCD098010625-Bromo-pyridine-2-carboxylic acid cyclopropylamideSCHEMBL349519DTXSID70650071MBQYBUFHINSBNB-UHFFFAOYSA-NAKOS012252167PS-3502
Show more names
N-cyclopropyl 5-bromopyridine-2-carboxamide2-Pyridinecarboxamide, 5-bromo-N-cyclopropyl-5-Bromo-N-cyclopropylpyridine-2-carboxamide ISO 9001：2015 REACH
DB-0733985-bromo-N-cyclopropyl-pyridine-2-carboxamideCS-0191866E90260F211742Z1065605110

Database identifiers

CAS
638219-77-9
PubChem CID
26370089
DTXSID
DTXSID70650071

Properties

Computed structural properties

XLogP
1.7
Topological polar surface area
42 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
13

Physicochemical properties

Boiling point
389.5 · 389.5±27.0 °C(Predicted)
Density
1.62 · 1.62±0.1 g/cm3(Predicted)
storage temp.
2 · 2-8°C
pka
13.24 · 13.24±0.20(Predicted)
Hazard Codes
Xi,Xn
Risk Statements
22 · 22-36

Safety & regulation

Safety data

hs_code
2933399990
risk_code
22-36
hazard_code
Xi,Xn
safety_code
26

Chemistry & industry

Upstream & downstream products

Suppliers15 total

Aladdin Scientific[email protected]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
南京代盟化工有限公司02566880956 · [email protected]
宝鸡缔都医药化工有限公司029-81145305 17791533577 · [email protected]

Related reactions

5 records
New reaction record

Linked notes

Loading…