1,4-비스(이소시아네이토메틸)사이클로헥산
1,4-Bis(isocyanatomethyl)cyclohexane
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기본 정보
- CAS
10347-54-3- 표준 SMILES
O=C=NCC1CCC(CN=C=O)CC1- InChIKey
ROHUXHMNZLHBSF-UHFFFAOYSA-N- 분자식
- C10H14N2O2
- 평균 분자량
- 194.23 g/mol
- 단동위원소 질량
- 194.10552769
이름 및 식별자
- 우선 이름
- 1,4-Bis(isocyanatomethyl)cyclohexane
- IUPAC
- 1,4-bis(isocyanatomethyl)cyclohexane
- 현지명
- 1,4-비스(이소시아네이토메틸)사이클로헥산
- 영어명
- 1,4-bis(isocyanatomethyl)cyclohexane
- 분자식
- C10H14N2O2
- 분자량
- 194.23
이름 및 동의어
1,4-BIS(ISOCYANATOMETHYL)CYCLOHEXANE10347-54-3EINECS 233-757-21,4-Bis(aminomethyl)cyclohexane diisocyanate1,4-Cyclohexane bis(methylisocyanate)Cyclohexane, 1,4-bis(isocyanatomethyl)-DTXSID2065046RefChem:73143DTXCID5032810233-757-21,4-Bis(methylisocyanate)cyclohexaneSCHEMBL44332
이름 더 보기
1,4-비스(이소시아네이토메틸)사이클로헥산CYCLOHEXANE,1,4-BIS(ISOCYANATOMETHYL)-1,4-Cyclohexanebis(methylene isocyanate)[(1,4-Cyclohexanediyl)bismethylene]diisocyanate[(Cyclohexane-1,4-diyl)bismethylene]bisisocyanate
1,4-Bis(methylisocyanate)cyclohexane [Diisocyanates]SCHEMBL1081546SCHEMBL1081557ROHUXHMNZLHBSF-AOOOYVTPSA-NROHUXHMNZLHBSF-MGCOHNPYSA-N1,4-diisocyanato methylcyclohexaneDTXSID6010315011,4-bis(isocyanatomethyl)-cyclohexane
데이터베이스 식별자
- CAS
10347-54-3、98458-83-4- PubChem CID
- 61504
- DTXSID
DTXSID2065046- EC Number
- 233-757-2、825-609-6
- Nikkaji
- J173.799F、J3.483.313C、J3.676.225J
물성
구조 계산 물성보충 중
- XLogP
- 3.5
- 극성 표면적
- 58.9 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 14
- 형식 전하
- 0
- 복잡도
- 229
물리화학적 성질
- 끓는 점
- 294 ℃ · 294℃
- 밀도
- 1.14 · 1.14
- 인화점
- 119 ℃ · 119℃
- EPA
- 1 · 1,4-Bis(isocyanatomethyl)cyclohexane (10347-54-3)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P233, P260, P261, P264, P264+P265, P270, P271, P272, P280, P284, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P316, P317, P319, P320, P321, P330, P331, P332+P317, P333+P317, P337+P317, P342+P316, P362+P364, P403, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 94 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
유해성 정보
Regulatory InformationStatus: Active Update: 11-09-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/26702
DOT LabelPoison
Fire HazardsExcerpt from ERG Guide 156 [Substances - Toxic and/or Corrosive (Combustible / Water-Sensitive)]:
Health HazardsExcerpt from ERG Guide 156 [Substances - Toxic and/or Corrosive (Combustible / Water-Sensitive)]:
Reactive GroupIsocyanates and Isothiocyanates
Reactivity Profile
Isocyanates and thioisocyanates, such as 1,4-BIS(METHYLISOCYANATE)CYCLOHEXANE, are incompatible with many classes of compounds, reacting exothermically to release toxic gases. Reactions with amines, aldehydes, alcohols, alkali metals, ketones, mercaptans, strong oxidizers, hydrides, phenols, and peroxides can cause vigorous releases of heat. Acids and bases initiate polymerization reactions in these materials. Some isocyanates react with water to form amines and liberate carbon dioxide. Base-catalysed reactions of isocyanates with alcohols should be carried out in inert solvents. Such reactions in the absence of solvents often occur with explosive violence, [Wischmeyer(1969)].
Air and Water ReactionsNo rapid reaction with air. No rapid reaction with water.
Hazard Classes and Categories
Acute Tox. 4 (100%)
Acute Tox. 4 (100%)
안전 및 보호
Fire FightingExcerpt from ERG Guide 156 [Substances - Toxic and/or Corrosive (Combustible / Water-Sensitive)]:
First AidExcerpt from ERG Guide 156 [Substances - Toxic and/or Corrosive (Combustible / Water-Sensitive)]:
Nonfire Spill ResponseExcerpt from ERG Guide 156 [Substances - Toxic and/or Corrosive (Combustible / Water-Sensitive)]:
Isolation and EvacuationExcerpt from ERG Guide 156 [Substances - Toxic and/or Corrosive (Combustible / Water-Sensitive)]:
Personal Protective Equipment (PPE)Excerpt from ERG Guide 156 [Substances - Toxic and/or Corrosive (Combustible / Water-Sensitive)]:
안전 데이터
- tsca
- TSCA listed
화학 및 산업
용도 및 제조
General Manufacturing InformationCyclohexane, 1,4-bis(isocyanatomethyl)-: INACTIVE
관련 반응
13건
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