3-Hexylpyridine

HCID 22766
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Basic information

CAS
6311-92-8
Standard SMILES
CCCCCCc1cccnc1
InChIKey
LWEQIZSFZFUWIE-UHFFFAOYSA-N
Molecular formula
C11H17N
Average molar mass
163.26 g/mol
Monoisotopic mass
163.13609954

Overview

3-Hexylpyridine is a member of pyridines.

Names & identifiers

Preferred name
3-Hexylpyridine
IUPAC
3-hexylpyridine
English name
3-N-HEXYLPYRIDINE
Molecular formula
C11H17N
Molecular weight
163.26

Names & synonyms

3-HEXYLPYRIDINE6311-92-8DTXSID00212449NSC 42647RefChem:502220DTXCID50134940676-822-43-N-hexylpyridinePyridine, 3-hexyl-Pyridine, 3-hexylMFCD02683071NSC-42647
Show more names
3-hexyl pyridine3-hexyl-pyridineNSC42647MD353QCV8F3-n-Hexylpyridine, 98+%SCHEMBL533685SCHEMBL919570SCHEMBL1336571

Database identifiers

CAS
6311-92-8
PubChem CID
22766
DTXSID
DTXSID00212449
ChEBI
CHEBI:173435
UNII
MD353QCV8F
EC Number
676-822-4
Nikkaji
J191.592D

Properties

Computed structural properties

XLogP
3.5
Topological polar surface area
12.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
5
Heavy atoms
12

Experimental & physicochemical properties

SpringerMaterials PropertiesSurface tension
Boiling Point241.00 to 243.00 °C. @ 760.00 mm Hg

Physicochemical properties

Density
0 · 0,903 g/cm3
storage temp.
2 · 2-8°C
LogP
3.887 · 3.887 (est)
FDA UNII
353 QCV8F · MD353QCV8F
Symbol(GHS)
7 · GHS07
Hazard statements
315 · H315-H319-H335

Safety & regulation

GHS classification

GHS Classification · 5 items

This chemical does not meet GHS hazard criteria for 20% (1 of 5) of reports.

Warning

H315 (80%): 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 5 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Safety data

risk_code
36/37/38
Symbol(GHS)
GHS07
safety_code
26-36/37/39
Hazard statements
H315-H319-H335
Precautionary statements
P261-P280a-P304+P340-P305+P351+P338-P405-P501a

Chemistry & industry

Pharmacology

Cellular LocationsMembrane

Suppliers13 total

北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
杭州品高化工有限公司0571-87658025 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]

Additional notes

DefinitionChEBI: 3-Hexylpyridine is a member of pyridines.

Related reactions

2 records
New reaction record

Compound notes

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