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8-Oxabicyclo(5.1.0)octane

HCID 67512
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
286-45-3
Standard SMILES
C1CCC2OC2CC1
InChIKey
MLOZFLXCWGERSM-UHFFFAOYSA-N
Molecular formula
C7H12O
Average molar mass
112.17 g/mol
Monoisotopic mass
112.088815

Names & identifiers

Preferred name
8-Oxabicyclo(5.1.0)octane
IUPAC
8-oxabicyclo[5.1.0]octane
English name
1,2-EPOXYCYCLOHEPTANE
Molecular formula
C7H12O
Molecular weight
112.17

Names & synonyms

8-Oxabicyclo[5.1.0]octane286-45-38-Oxabicyclo(5.1.0)octaneEINECS 206-009-8DTXSID60951266RefChem:548358DTXCID101379394206-009-81,2-EpoxycycloheptaneCycloheptene oxideCycloheptene epoxideCycloheptane, 1,2-epoxy-
Show more names
Cycloheptene,oxideCyclohepteneepoxideCycloheptane,1,2-epoxy-
Epoxycycloheptanecis-1,2-EpoxycycloheptaneSCHEMBL521871,2-Epoxycycloheptane, 95%8-oxa-bicyclo[5.1.0]octaneSCHEMBL2799700SCHEMBL5185112SCHEMBL5880678

Database identifiers

CAS
286-45-3
PubChem CID
67512
DTXSID
DTXSID60951266
EC Number
206-009-8
Nikkaji
J99.887G

Properties

Computed structural properties

XLogP
1.7
Topological polar surface area
12.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
0
Heavy atoms
8
Formal charge
0
Complexity
80.4

Experimental & physicochemical properties

SpringerMaterials PropertiesSchoenflies notation

Physicochemical properties

Boiling point
65 · 65-67 °C(Press: 25 Torr)
Density
0.983 · 0.983±0.06 g/cm3(Predicted)
refractive index
20 · n20/D 1.464
Flash point
30 °C · 30°C
UNSPSC Code
12352100 · 12352100
NACRES
22 · NA.22
Symbol(GHS)
2 · GHS02,GHS05,GHS07
Signal word
Danger
Hazard statements
226 · H226-H302+H312+H332-H314
Precautionary statements
210 · P210-P280-P301+P312-P303+P361+P353-P304+P340+P310-P305+P351+P338
Hazard Codes
C
Risk Statements
10 · 10-20/21/22-34

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

H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P240, P241, P242, P243, P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P321, P330, P362+P364, P363, P370+P378, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 41 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesFlam. Liq. 3 (100%)

Safety data

wgk
3
ridadr
UN 2924 3/PG 3
risk_code
10-20/21/22-34
Signal word
Danger
Symbol(GHS)
GHS02,GHS05,GHS07
hazard_code
C
safety_code
26-36/37/39-45
Hazard statements
H226-H302+H312+H332-H314
Precautionary statements
P210-P280-P301+P312-P303+P361+P353-P304+P340+P310-P305+P351+P338

Chemistry & industry

Upstream & downstream products

Downstream products

Cycloheptanol2-Cyclohepten-1-one(R,R)-(-)-1,2-CYCLOHEPTANEDIOL

Suppliers18 total

Syntechem Co.,Ltd[email protected]
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
安耐吉化学&3A(安徽泽升科技股份有限公司)400-0056266 · [email protected]
江苏艾康生物医药研发有限公司025-66028182 17714375163 · [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]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
陕西缔都医药化工有限公司+86-29-81139210 +86-17392587031 · [email protected]
上海源叶生物科技有限公司13636370518 · [email protected]
上海颖心实验室设备有限公司

Related reactions

17 records
New reaction record
HRID 227688 reaction equation
HRID 227688As productuspto-grants-2009_07
HRID 237011 reaction equation
HRID 237011As reactantuspto-grants-1979_06
HRID 237012 reaction equation
HRID 237012As reactantuspto-grants-1979_06
HRID 263068 reaction equation
HRID 263068As reactantuspto-grants-1979_05
HRID 303117 reaction equation
HRID 303117As reactantTraining data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID 337719 reaction equation
HRID 337719As reactantuspto-grants-2014_11
HRID 427133 reaction equation
HRID 427133As reactantuspto-grants-1979_10
HRID 427134 reaction equation
HRID 427134As reactantuspto-grants-1979_10
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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Safety Statements
26 · 26-36/37/39-45
RIDADR
2924 · UN 2924 3/PG 3
WGK Germany
3 · 3
021-021-59178156 15300768757 · [email protected]
上海立崎生物医学研究中心18014399201 · [email protected]
Aladdin Scientific[email protected]
杭州里德伯生物科技有限公司13616542515 · [email protected]
南京康满林化工实业有限公司025-83697070 13770331960 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
上海鼓臣生物技术有限公司021-34675735 19147740836 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]