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3,5-Dibromo-4-chloro-2,6-dimethylpyridine

HCID 3589112
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Basic information

CAS
633318-46-4
Standard SMILES
Cc1nc(C)c(Br)c(Cl)c1Br
InChIKey
SFOGWSXQURLBNE-UHFFFAOYSA-N
Molecular formula
C7H6Br2ClN
Average molar mass
299.39 g/mol
Monoisotopic mass
296.85555107

Names & identifiers

Preferred name
3,5-Dibromo-4-chloro-2,6-dimethylpyridine
IUPAC
3,5-dibromo-4-chloro-2,6-dimethylpyridine
English name
3,5-Dibromo-4-chloro-2,6-dimethylpyridine
Molecular formula
C7H6Br2ClN
Molecular weight
299.39

Names & synonyms

3,5-dibromo-4-chloro-2,6-dimethylpyridine633318-46-4DTXSID90393938RefChem:271592DTXCID403447983,5-dibromo-4-chloro-2,6-dimethyl-pyridineMFCD02668260Pyridine, 3,5-dibromo-4-chloro-2,6-dimethyl-SCHEMBL17006829SFOGWSXQURLBNE-UHFFFAOYSA-NAKOS024261439SY283313
Show more names
DB-128144CS-0085453Y11638F604421

Database identifiers

CAS
633318-46-4
PubChem CID
3589112
DTXSID
DTXSID90393938
EC Number
159-718-9
Nikkaji
J2.377.104G

Properties

Computed structural properties

XLogP
3.7
Topological polar surface area
12.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
0
Heavy atoms
11
Formal charge
0
Complexity
130

Physicochemical properties

Boiling point
282.6 · 282.6±35.0 °C(Predicted)
Density
1.876 · 1.876±0.06 g/cm3(Predicted)
storage temp.
Store at room temperature
pka
2.35 · 2.35±0.10(Predicted)
Appearance
White to off-white Solid
HS Code
2933399990 · 2933399990

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Danger

H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, 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. 3 (100%)

Safety data

hs_code
2933399990

Related reactions

4 records
New reaction record
HRID 718332 reaction equation
HRID 718332As productuspto-grants-2015_11
HRID 718333 reaction equation
HRID 718333As productuspto-grants-2015_11
HRID 718334 reaction equation
HRID 718334As reactantuspto-grants-2015_11
HRID 718367 reaction equation
HRID 718367As reactantuspto-grants-2015_11

Compound notes

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