Methyl 2-(4-bromopyridin-2-yl)acetate

HCID 84071108CAS 1354021-08-1
Substructure searchFind similar structures

Basic information

Standard SMILES
COC(=O)Cc1cc(Br)ccn1
InChIKey
URIFFMIHLPERQQ-UHFFFAOYSA-N
Molecular formula
C8H8BrNO2
Average molar mass
230.06 g/mol

Names & identifiers

Preferred name
Methyl 2-(4-bromopyridin-2-yl)acetate
IUPAC
methyl 2-(4-bromo-2-pyridinyl)acetate
English name
methyl 2-(4-bromopyridin-2-yl)acetate
Molecular formula
C8H8BrNO2
Molecular weight
230.06

Names & synonyms

methyl 2-(4-bromopyridin-2-yl)acetate1354021-08-1RefChem:813488967-718-2Methyl 2-(4-bromo-2-pyridyl)acetateMFCD21025848methyl2-(4-bromopyridin-2-yl)acetateSCHEMBL15709888SCHEMBL31252708URIFFMIHLPERQQ-UHFFFAOYSA-NAKOS023833068AS-63041
Show more names
SY038450DB-255177CS-01406172-Pyridineacetic acid, 4-bromo-, methyl esterF539221methyl 2-(4-bromo-2-pyridyl)acetate - [M82461]

Database identifiers

CAS
1354021-08-1
PubChem CID
84071108
EC Number
967-718-2

Properties

Computed structural properties

XLogP
1.4
Topological polar surface area
39.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
12

Physicochemical properties

storage temp.
-20 °C · Inert atmosphere,Store in freezer, under -20°C
Appearance
Light yellow to yellow Liquid
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
280 · P280-P305+P351+P338

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P280-P305+P351+P338

Chemistry & industry

Suppliers50 total

上海凌富药物研究有限公司+86(21)5895 0110 19945755304 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
Compound Net Biotechnology Inc.15266686121 · [email protected]
常州稀亚生物科技有限公司13775267187

Related reactions

2 records
New reaction record

Linked notes

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