HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.8.0
  1. Home
  2. /Compound

Bromocyclopentane

HCID 8728
New noteNew reactionRequest quotes
Print preview
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
137-43-9
Standard SMILES
BrC1CCCC1
InChIKey
BRTFVKHPEHKBQF-UHFFFAOYSA-N
Molecular formula
C5H9Br
Average molar mass
149.03 g/mol
Monoisotopic mass
147.98876239

Names & identifiers

Preferred name
Bromocyclopentane
IUPAC
bromocyclopentane
English name
Bromocyclopentane
Molecular formula
C5H9Br
Molecular weight
149.03

Names & synonyms

BromocyclopentaneCYCLOPENTYL BROMIDECyclopentane, bromo-NSC 1110EINECS 205-294-6AI3-23448DTXSID9059670EC 205-294-6RefChem:121572DTXCID1034393205-294-6BRTFVKHPEHKBQF-UHFFFAOYSA-N
Show more names
Cyclopentane BromideBromocylopentanebromo-cyclopentanAKOS BBS-00004279Cyclopentane,bromo-Bromopentyl bromideBromocyclopentane>
InChI=1/C5H9Br/c6-5-3-1-2-4-5/h5H,1-4H137-43-9cyclopentylbromide1-bromocyclopentanebromo-cyclopentaneMFCD00001359QP65Z83BNYNSC-1110

Database identifiers

CAS
137-43-9
PubChem CID
8728
DTXSID
DTXSID9059670
UNII
QP65Z83BNY
EC Number
205-294-6
Nikkaji
J132.737B

Properties

Computed structural properties

XLogP
2.3
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
0
Heavy atoms
6
Formal charge
0
Complexity
37.2

Experimental & physicochemical properties

SpringerMaterials PropertiesSchoenflies notation

Physicochemical properties

Boiling point
137 · 137-139 °C (lit.)
Density
1.39 g/mL · 1.39 g/mL at 25 °C (lit.)
refractive index
20 · n20/D 1.4881(lit.)
Flash point
95 °F · 95 °F
storage temp.
Store at R.T.
solubility
Chloroform, Ethyl Acetate (Slightly)
form
Liquid
Specific Gravity
1.39 · 1.39
color
Clear yellow to light brown
Water Solubility
Immiscible with water.
BRN
1209256 · 1209256
Stability
Stable. Flammable. Incompatible with strong oxidizing agents, strong bases.
InChI

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

Warning

H226 (98.8%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 82 reports by companies from 5 notifications to the ECHA C&L Inventory.

Hazard information

Regulatory Information · 3 items

Chemical: Cyclopentane, bromo-

Status: Active Update: 12-02-2019 https://echa.europa.eu/registration-dossier/-/registered-dossier/15852

Bromocyclopentane: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and CategoriesFlam. Liq. 3 (98.8%)

Safety data

F
8
PPE
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
wgk
3
tsca
TSCA listed
ridadr
UN 1993 3/PG 3
hs_code
29035990
risk_code
10
Signal word
Warning
Symbol(GHS)
GHS02
safety_code
23-24/25-16
hazard_class
3
Storage Class
3 - Flammable liquids

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationCyclopentane, bromo-: ACTIVE
Applications · 1 item

UsesBromocyclopentane is a precursor used in the preparation of cyclopentene and cyclopentanol. It is a fatty bromide, which is used as a solvent. It is used as an intermediate for the preparation of surfactant and pharmaceuticals and other organic compounds. It is also used in the production of the medicine cyclopentathiazide.

Preparation methods · 1 item

PreparationBromocyclopentane is synthesized by bromination of cyclopentanol: cyclopentanol is mixed with hydrobromic acid and heated to about 170°C refluxed for 6-8h. Then distilled with water steam, the oil layer is washed with 5% sodium carbonate, then dried, filtered, fractionated and collected 136-139°C fraction is the finished product. Another method is by the reaction of cyclopentanol and phosphorus tribromide: the cyclopentanol is cooled to 0 ℃, add the newly evaporated phosphorus tribromide drop by drop, add it all at 0-5 ℃, stir for 2h, and leave it at room temperature overnight. Add water and stratify, take the oil layer water distillation. Distillate stratification, the oil layer was washed with 10% sodium bicarbonate solution, dried with anhydrous calcium chloride, filtration, filtrate distillation, collect 134-141 ℃ fraction that is bromocyclopentane.

Upstream & downstream products

Upstream raw materials

CyclopentanolCyclopentaneCyclopentanoneCyclopentene, 4-bromo-1,2-Dibromocyclopentane

Related reactions

651 records
New reaction record
HRID 918 reaction equation
HRID 918As reactantuspto-grants-1998_03
HRID 7395 reaction equation
HRID 7395As reactantuspto-grants-2006_08
HRID 8879 reaction equation
HRID 8879As reactantuspto-grants-2006_08
HRID 20625 reaction equation
HRID 20625As reactantuspto-grants-2010_06
HRID 21464 reaction equation
HRID 21464As reactantuspto-grants-1995_06
HRID 21471 reaction equation
HRID 21471As reactantuspto-grants-1995_06
HRID 21473 reaction equation
HRID 21473As reactantuspto-grants-1995_06
HRID 22361 reaction equation
HRID 22361As reactantuspto-grants-1995_06
Page 1 of 82

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
More actions
New noteNew reactionRequest quotes
1S/C5H9Br/c6-5-3-1-2-4-5/h5H,1-4H2
InChIKey
BRTFVKHPEHKBQF-UHFFFAOYSA-N
SMILES
BrC1CCCC1
LogP
2.745 · 2.745 (est)
CAS DataBase Reference
137 · 137-43-9(CAS DataBase Reference)
FDA UNII
65 Z83BNY · QP65Z83BNY
NIST Chemistry Reference
Cyclopentane, bromo-(137-43-9)
EPA Substance Registry System
Cyclopentane, bromo- (137-43-9)
UNSPSC Code
12352100 · 12352100
NACRES
22 · NA.22
Symbol(GHS)
2 · GHS02
Signal word
Warning
Hazard statements
226 · H226
Precautionary statements
501 · P501-P240-P210-P233-P243-P241-P242-P280-P370+P378-P303+P361+P353-P403+P235
PPE
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
Risk Statements
10 · 10
Safety Statements
23 · 23-24/25-16
RIDADR
1993 · UN 1993 3/PG 3
WGK Germany
3 · 3
F
8 · 8
TSCA
TSCA listed
HazardClass
3 · 3
PackingGroup
III
HS Code
29035990 · 29035990
Storage Class
3 · 3 - Flammable liquids
Hazard Classifications
3 · Flam. Liq. 3
REACH Registrations
Active
Limited Quantities
5 L · 5.0 L (1.3 gallons) (liquid)
Excepted Quantities
Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)
packing_group
III
Hazard statements
H226
Limited Quantities
5.0 L (1.3 gallons) (liquid)
Excepted Quantities
Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)
REACH Registrations
Active
Hazard Classifications
Flam. Liq. 3
Precautionary statements
P501-P240-P210-P233-P243-P241-P242-P280-P370+P378-P303+P361+P353-P403+P235
Iodocyclopentane
1,2-dibromocyclopentane
Cyclopentyl methyl ether
Cyclopentene
Cyclobutanemethanol
1,3-Cyclopentadiene

Downstream products

3-Cyclopentyloxy-4-methoxybenzaldehydeQuinestrolCyclopentanemalonic acidDiethyl cyclopentylmalonateCyclopentylacetic acid1-Bromobutane2-Fluorophenyl cyclopentyl ketone(R)-3-(4-broMo-1H-pyrazol-1-yl)-3-cyclopentylpropanenitrileDL-CyclopentylglycineS- (+)-Rolipram