5-Bromo-2-(pyrrolidin-1-yl)pyrimidine

HCID 6622013CAS 446286-61-9
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Basic information

Standard SMILES
Brc1cnc(N2CCCC2)nc1
InChIKey
AKQGPROZPHKDMD-UHFFFAOYSA-N
Molecular formula
C8H10BrN3
Average molar mass
228.09 g/mol
Monoisotopic mass
227.00580942

Names & identifiers

Preferred name
5-Bromo-2-(pyrrolidin-1-yl)pyrimidine
IUPAC
5-bromo-2-pyrrolidin-1-ylpyrimidine
English name
5-Bromo-2-(pyrrolidin-1-yl)pyrimidine
Molecular formula
C8H10BrN3
Molecular weight
228.09

Names & synonyms

5-Bromo-2-(pyrrolidin-1-yl)pyrimidine446286-61-9DTXSID70425084RefChem:301578DTXCID103759185-Bromo-2-pyrrolidinopyrimidine5-bromo-2-pyrrolidin-1-ylpyrimidineMFCD00483243ChemDiv3_009394PYRIMIDINE, 5-BROMO-2-(1-PYRROLIDINYL)-HMS1499K225-bromo-2-(1-pyrrolidinyl)pyrimidine
Show more names
5-bromo-2-1-pyrrolidinylpyrimidine5-BROMO-2-(PYRROLIDIN-1-YL)PYRIMIDINE ISO 9001：2015 REACH1-(5-Bromopyrimidin-2-yl)pyrrolidine, 5-Bromo-2-(pyrrolidin-1-yl)-1,3-diazine
IDI1_027304CS-0037027AM803921BC0029195-Bromo-2-(porb3022769SCHEMBL1433020SCHEMBL20445942

Database identifiers

CAS
446286-61-9
PubChem CID
6622013
DTXSID
DTXSID70425084

Properties

Computed structural properties

XLogP
1.8
Topological polar surface area
29 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
12

Physicochemical properties

Boiling point
345 · 345.0±34.0 °C(Predicted)
Density
1.555 · 1.555±0.06 g/cm3(Predicted)
storage temp.
Store at room temperature
pka
2.44 · 2.44±0.42(Predicted)
Appearance
White to off-white Solid
Symbol(GHS)
7 · GHS07

Safety & regulation

Safety data

hs_code
2933599590
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xi,Xn
hazard_note
Irritant
Hazard statements
H302-H315-H319-H335

Chemistry & industry

Upstream & downstream products

Suppliers49 total

陕西格列弗生物科技研究有限责任公司13892423764 · [email protected]
陕西缔都新材料有限公司81124267 17392282731 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Aladdin Scientific[email protected]
Accendatech Co., Ltd.+undefined+86-13132578992 · [email protected]

Related reactions

1 records
New reaction record

Linked notes

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