Bicyclo(2.2.1)heptane

HCID 9233CAS 279-23-2

기본 정보

표준 SMILES: C1CC2CCC1C2
InChIKey: UMRZSTCPUPJPOJ-UHFFFAOYSA-N
분자식: C7H12
평균 분자량: 96.17 g/mol
단동위원소 질량: 96.09390038

개요

Norbornane is a cyclic hydrocarbon consisting of cyclohexane with a methylene bridge linking positions 1 and 4. It is a cyclic hydrocarbon and a bridged compound.

이름 및 식별자

우선 이름: Bicyclo(2.2.1)heptane
IUPAC: bicyclo[2.2.1]heptane
영어명: Norbornane
분자식: C7H12
분자량: 96.17

이름 및 동의어

Bicyclo[2.2.1]heptaneNorbornylaneNorcamphaneNorfenchaneNorsantaneBicyclo(2.2.1)heptanePAF9G8MY72NSC-91457DTXSID4075376Bicyclo2.2.1heptaneRefChem:568133DTXCID9037745

이름 더 보기

camphenilaneNSC 91457ORBORNANENorbornane>Norbornane,98%

205-996-2NORBORNANE279-23-21,4-EndomethylenecyclohexaneMFCD00074822Cyclohexane, 1,4-endo-methylene-(1s,4s)-bicyclo[2.2.1]heptaneNorbornane, 98%

데이터베이스 식별자

CAS: 279-23-2
PubChem CID: 9233
DTXSID: DTXSID4075376
ChEBI: CHEBI:71546
UNII: PAF9G8MY72
EC Number: 205-996-2
Nikkaji: J1.513J、J952.912H

물성

구조 계산 물성

XLogP: 3
극성 표면적: 0 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 0
회전 가능 결합 수: 0
무거운 원자 수: 7
형식 전하: 0
복잡도: 58.1

실험 및 물리화학적 성질

SolventsSolvents -> Aliphatics, Saturated (<C12)

SpringerMaterials PropertiesSchoenflies notation

LogP3.78

Vapor Pressure33.0 [mmHg]

Physical DescriptionWhite solid; [Acros Organics MSDS]

물리화학적 성질

녹는점: 85 · 85-88 °C (lit.)
끓는 점: 106 °C · 106 °C
밀도: 0.914 · 0.914±0.06 g/cm3 (20 ºC 760 Torr)
굴절률: 1.477 · 1.4770 (estimate)
인화점: -0.2 · -0.2±11.7℃
저장 조건: 2 · 2-8°C
용해도: 아세톤에 용해됨
물리적 상태: powder to crystal
색상: 흰색에서 거의 흰색
비열: 1.57 J/ · Cp(crystal): 1.57 J/(g·K), at 25℃
InChI: 1S/C7H12/c1-2-7-4-3-6(1)5-7/h6-7H,1-5H2/t6-,7+
InChIKey: UMRZSTCPUPJPOJ-KNVOCYPGSA-N
SMILES: C1C[C@@H]2CC[C@H]1C2
EPA: 2.2 · Bicyclo[2.2.1]heptane (279-23-2)

안전 및 규제

유해성 정보

Regulatory InformationBicyclo2.2.1heptane: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Hazards SummaryIntravenous LD50 (mouse) = 56 mg/kg; [RTECS] May cause irritation; [Acros Organics MSDS]

독성 정보

Adverse EffectsNeurotoxin - Acute solvent syndrome

안전 데이터

wgk: 3
rtecs: RB6945000
독성: mouse,LD50,intravenous,56mg/kg (56mg/kg),U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#04038,
HS 번호: 2902.19.0050
스토리지 클래스: 11 - Combustible Solids

화학 및 산업

응용 분야 · 1건

개요Norbornane (also known as bicyclo[2.2.1]heptane or norcamphane) is an organic compound and a saturated hydrocarbon with chemical formula C7H12. It is a crystalline compound with a melting point of 88 °C. The carbon skeleton is derived from cyclohexane ring with a methylene bridge in the 1,4- position, and is a bridged bicyclic compound. The compound is a prototype of a class of strained bicyclic hydrocarbons.

제조 방법

Norbornane is obtained by adding ethylene to cyclopentadiene under heat and pressure and then hydrogenating.

상·하류 제품 정보

상류 원료

에틸렌 시클로펜타디엔

하류 제품

비시클로[2.2.1]헵탄,1-브로모-(9CI)NORCAMPHOR

공급사46 곳

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]

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Syntechem Co.,Ltd[email protected]

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추가 설명

정의ChEBI: Norbornane is a cyclic hydrocarbon consisting of cyclohexane with a methylene bridge linking positions 1 and 4. It is a bridged compound and a cyclic hydrocarbon.

연결된 노트

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