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2-((4-Chlorophenoxy)methyl)oxirane

HCID 91515
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
2212-05-7
Standard SMILES
Clc1ccc(OCC2CO2)cc1
InChIKey
KSLSZOOZWRMSAP-UHFFFAOYSA-N
Molecular formula
C9H9ClO2
Average molar mass
184.62 g/mol
Monoisotopic mass
184.02910721

Names & identifiers

Preferred name
2-((4-Chlorophenoxy)methyl)oxirane
IUPAC
2-[(4-chlorophenoxy)methyl]oxirane
English name
4-Chlorophenyl glycidyl ether
Molecular formula
C9H9ClO2
Molecular weight
184.62

Names & synonyms

2212-05-72-[(4-chlorophenoxy)methyl]oxirane4-Chlorophenyl 2,3-epoxypropyl ether2-((4-Chlorophenoxy)methyl)oxiraneKSLSZOOZWRMSAP-UHFFFAOYSA-RefChem:449014218-655-8InChI=1/C9H9ClO2/c10-7-1-3-8(4-2-7)11-5-9-6-12-9/h1-4,9H,5-6H24-Chlorophenyl glycidyl etherp-Chlorophenyl glycidyl etherChlorophenyl glycidyl ether2-(4-chlorophenoxymethyl)oxirane
Show more names
chlorophenylglycidyletherPARA-CHLOROPHENYLGLYCIDYLETHER((4-chlorophenoxy)methyl)oxirane((4-chlorophenoxy)methyl)-oxiran4-Chlorophenyl glycidyl ether 99%
2-(4-CHLORO-PHENOXYMETHYL)-OXIRANE1,2-Epoxy-3-chlorophenoxypropaneNSC 602601,2-Epoxy-3-(p-chlorophenoxy)propanePropane, 1-(p-chlorophenoxy)-2,3-epoxy-MFCD00005134p-Chlorophenyl 2,3-epoxypropyl etherOxirane, ((4-chlorophenoxy)methyl)-

Database identifiers

CAS
2212-05-7
PubChem CID
91515
DTXSID
DTXSID701357944
EC Number
218-655-8
Nikkaji
J166J

Properties

Computed structural properties

XLogP
2.2
Topological polar surface area
21.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
12
Formal charge
0
Complexity
143

Physicochemical properties

Melting point
31 · 31-33 °C (lit.)
Boiling point
263.86 °C · 263.86°C (rough estimate)
Density
1.1989 · 1.1989 (rough estimate)
refractive index
20 · n20/D 1.545(lit.)
Flash point
225 °F · 225 °F
form
solid
InChI
1S/C9H9ClO2/c10-7-1-3-8(4-2-7)11-5-9-6-12-9/h1-4,9H,5-6H2
InChIKey
KSLSZOOZWRMSAP-UHFFFAOYSA-N
SMILES
Clc1ccc(OCC2CO2)cc1
EWG's Food Scores
1 · 1
EPA Substance Registry System
Oxirane, [(4-chlorophenoxy)methyl]- (2212-05-7)
UNSPSC Code
12162002 · 12162002
NACRES
23 · NA.23
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
317 · H317-H315-H319-H412-H335-H332

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

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

P261, P264, P264+P265, P271, P272, P273, P280, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P332+P317, P333+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 CategoriesSkin Irrit. 2 (100%)

Safety data

PPE
Eyeshields, Gloves, type N95 (US)
wgk
3
rtecs
TX5600000
Signal word
Warning
Symbol(GHS)
GHS07
Storage Class
11 - Combustible Solids
Hazard statements
H317-H315-H319-H412-H335-H332
Precautionary statements
P264-P280-P305+P351+P338-P337+P313P-P261-P271-P304+P340-P312-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P264-P280-P302+P352-P321-P332+P313-P362-P273-P501

Chemistry & industry

Suppliers12 total

Aladdin Scientific[email protected]
烟台盛凯伦生物制品有限公司13356901049 · [email protected]
常熟泓德生物科技有限公司18951116523 17712623939 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
郑州盖科科技有限公司0371-63336364 17344886665 · [email protected]
Alfa Chemistry1-516-6625404 · [email protected]
安耐吉化学&3A(安徽泽升科技股份有限公司)400-0056266 · [email protected]
上海思言生物科技有限公司021-50908862,442785678,326799392 18721037013 · [email protected]
上海康曼生物科技有限公司18800375331 · [email protected]
北京博森诺康医药科技有限公司010-86203349 18201082367 · [email protected]
榆林润天畅化工有限责任公司15890142075 15890142075 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]

Related reactions

22 records
New reaction record
HRID 138370 reaction equation
HRID 138370As reactantTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 237776 reaction equation
HRID 237776As productuspto-grants-2014_02
HRID 239017 reaction equation
HRID 239017As reactantuspto-grants-2014_02
HRID 239023 reaction equation
HRID 239023As reactantuspto-grants-2014_02
HRID 297060 reaction equation
HRID 297060As reactantTraining data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID 366922 reaction equation
HRID 366922As reactantuspto-grants-2000_10
HRID 544420 reaction equation
HRID 544420As reactantuspto-grants-1984_05
HRID 696939 reaction equation
HRID 696939As reactantTraining data from https://doi.org/10.1039/C8SC04228D (3/10)
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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Precautionary statements
264 · P264-P280-P305+P351+P338-P337+P313P-P261-P271-P304+P340-P312-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P264-P280-P302+P352-P321-P332+P313-P362-P273-P501
PPE
95 · Eyeshields, Gloves, type N95 (US)
WGK Germany
3 · 3
RTECS
5600000 · TX5600000
Storage Class
11 · 11 - Combustible Solids