Basic information
- CAS
13626-17-0- Standard SMILES
Clc1c(Br)cncc1Br- InChIKey
XNXHPEUZNXWWCH-UHFFFAOYSA-N- Molecular formula
- C5H2Br2ClN
- Average molar mass
- 271.34 g/mol
- Monoisotopic mass
- 268.82425094
Names & identifiers
- Preferred name
- 3,5-Dibromo-4-chloropyridine
- IUPAC
- 3,5-dibromo-4-chloropyridine
- English name
- 3,5-DIBROMO-4-CHLOROPYRIDINE
- Molecular formula
- C5H2Br2ClN
- Molecular weight
- 271.34
Names & synonyms
3,5-dibromo-4-chloropyridine13626-17-0DTXSID70355736RefChem:271593DTXCID40306795852-183-94-CHLORO-3,5-DIBROMOPYRIDINEMFCD00233993Pyridine, 3,5-dibromo-4-chloro-3,5-dibromo4-chloropyridineSCHEMBL1938836AMY26060
Show more names
3,5-Dibromo-4-chL3,5-DIBROMO-4-CHLOROPYRIDINE ISO 9001：2015 REACH
BCP102313,5-Dibromo-4-chloropyridine, 98%3,5-dibromo-4-chloro-pyridineAKOS015891847CS-W021808PB24627AC-23106AS-19836
Database identifiers
- CAS
13626-17-0- PubChem CID
- 817094
- DTXSID
DTXSID70355736- EC Number
- 852-183-9
- Nikkaji
- J1.272.604J
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 12.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 91
Physicochemical properties
- Melting point
- 98 °C · 98 °C
- Boiling point
- 256.4 · 256.4±35.0 °C(Predicted)
- Density
- 2.136 · 2.136±0.06 g/cm3(Predicted)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- form
- solid
- pka
- 0.3 · 0.30±0.10(Predicted)
- Appearance
- Off-white to light yellow Solid
- InChI
- 1S/C5H2Br2ClN/c6-3-1-9-2-4(7)5(3)8/h1-2H
- InChIKey
- XNXHPEUZNXWWCH-UHFFFAOYSA-N
- SMILES
- Clc1c(Br)cncc1Br
- CAS DataBase Reference
- 13626 · 13626-17-0
- UNSPSC Code
- 12352200 · 12352200
- NACRES
- 21 · NA.21
- Symbol(GHS)
- 6 · GHS06
- Signal word
- Danger
- Hazard statements
- 301 · H301
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
Danger
H301 (50%): Toxic if swallowed [Danger Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, 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 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 3 (50%)
Safety data
- wgk
- 3
- ridadr
- UN 2811 6.1 / PGIII
- risk_code
- 25
- Signal word
- Danger
- Symbol(GHS)
- GHS06
- hazard_code
- T
- safety_code
- 45
- Storage Class
- 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects
- Hazard statements
- H301
- Hazard Classifications
- Acute Tox. 3 Oral
- Precautionary statements
- P301+P310
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers100 total
阜新奥瑞凯精细化工有限公司0418-5113999 18740177324 · [email protected]
苏州道澜生物医药科技有限公司15952404857 · [email protected]
Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]
上海凌富药物研究有限公司+86(21)5895 0110 19945755304 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
上海衡新化工科技有限公司13917104483; 13917104483 · [email protected]
郑州汇聚化工有限公司13393710386 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.
Related reactions
10 records
Compound notes
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