메틸렌 비스(4-사이클로헥실아아이소사이안산)(메틸렌 비스(4-사이클로헥실아이소시안산))

1,1""-메틸렌비스 · 메틸렌비스(4-사이클로헥실아아이소사이안산)(메틸렌비스(4-사이클로헥실아이소시안산)) · 1,1'-메틸렌비스[4-이소시아나토시클로헥산] · 메틸렌 비스(4-사이클로헥실아이소사이안산) · 1,1'-메틸렌비스(4-이소시아나토시클로헥산) · rmdi · dmdi · smdi

https://huagongshe.com/ko/chemical/21202

메틸렌 비스(4-사이클로헥실아아이소사이안산)(메틸렌 비스(4-사이클로헥실아이소시안산)) 분자 구조식

식별자 및 물리적 특성

CAS No.	13622-90-7
분자식	C15H22N2O2
평균 분자량	262.35 g/mol
단동위원소 질량	262.16812794 g/mol
SMILES	O=C=NC1CCC(CC2CCC(N=C=O)CC2)CC1
InChIKey	KORSJDCBLAPZEQ-UHFFFAOYSA-N
PubChem CID	21202
ChEMBL	CHEMBL1878565
ChEBI	CHEBI:53216
EC No.	225-863-2
DTXSID	DTXSID3027588
현지명	메틸렌 비스(4-사이클로헥실아아이소사이안산)(메틸렌 비스(4-사이클로헥실아이소시안산))

화학 및 물리적 성질

XLogP	5.3
극성 표면적	58.9
수소 결합 공여자 수	0
수소 결합 수용자 수	4
회전 가능 결합 수	4
무거운 원자 수	19
형식 전하	0
복잡도	332
Polymers	Plastics & Rubber -> Diisocyanates
SpringerMaterials Properties	Boiling point
밀도	1.07 at 77 °F (NIOSH, 2024) - Denser than waterwill sink1.066 g/cu cm(77 °F): 1.071.066 g/mL at 25 °C(lit.)
Color/Form	Clear, colorless to light-yellow liquid
용해도	Reacts with water (NIOSH, 2024)Soluble in acetone클로로포름(약간 용해됨), 메탄올(약간 용해됨)
인화점	greater than 395 °F (NIOSH, 2024)>395 °F>230 °F
Decomposition	When heated to decomposition it emits tocix fumes of /chlorine/.
녹는점	less than 14 °F (NIOSH, 2024)<14 °F25°C
Polymerization	May slowly polymerize if heated above 122 °F.
증기압	0.001 mmHg at 77 °F (NIOSH, 2024)0.0000233 [mmHg]VP: 0.001 mm Hg at 25 °C0.001 mmHg at 77 °F(77 °F): 0.001 mmHg0.001Pa at 20℃
Food Contact Substances	FCS -> FDA Inventory of Food Contact Substances Listed in 21 CFR
굴절률	Index of refraction = 1.4970 at 20 °C/Dn20/D 1.497(lit.)
끓는 점	168 °C / 1.5mmHg
물리적 상태	액체
색상	무색의
용해도	불용성/반응성
BRN	2217800
안정성	흡습성
주요 응용	환경
InChI	1S/C15H22N2O2/c18-10-16-14-5-1-12(2-6-14)9-13-3-7-15(8-4-13)17-11-19/h12-15H,1-9H2
InChIKey	KORSJDCBLAPZEQ-UHFFFAOYSA-N
SMILES	O=C=NC1CCC(CC1)CC2CCC(CC2)N=C=O
LogP(분배 계수)	6.11 at 20℃
NIST	Cyclohexane, 1,1'-methylenebis[4-isocyanato-(5124-30-1)
EPA	1,1-Methylene bis(4-isocyanatocyclohexane) (5124-30-1)

화학적 성질

Liquid.Soluble in acetone;reacts with water or ethanol.

안전 및 규제

GHS 분류	DangerH315: Causes skin irritation [Warning Skin corrosion/irritation]P233, P260, P261, P264, P264+P265, P271, P272, P280, P284, P302+P352, P304+P340, P305+P351+P338, P316, P319, P321, P332+P317, P333+P317, P337+P317, P342+P316, P362+P364, P403, P403+P233, P405, and P501 (click each P-code to see the statement)This chemical does not meet GHS hazard criteria for 3.6% (37 of 1034) of reports.H315 (96.4%): Causes skin irritation [Warning Skin corrosion/irritation]
규제 정보	Chemical: Cyclohexane, 1,1'-methylenebis[4-isocyanato-Hazard Traits - Respiratory ToxicityCyclohexane, 1,1'-methylenebis[4-isocyanato- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Cyclohexane, 1,1'-methylenebis[4-isocyanato- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.Status: Active Update: 16-05-2023 https://echa.europa.eu/registration-dossier/-/registered-dossier/13842Restricted substance: 4,4'-methylenedicyclohexyl diisocyanate
운송 라벨(DOT)	Poison
화재 위험	Flash point data for this chemical are not available. It is probably combustible. (NTP, 1992)
건강 유해성	Excerpt from NIOSH Pocket Guide for Methylene bis(4-cyclohexylisocyanate):
유해성 요약	See ISOCYANATES.
반응성 그룹	Isocyanates and Isothiocyanates
TSCA 요건	Section 8(a) of TSCA requires manufacturers of this chemical substance to report preliminary assessment information concerned with production, exposure, and use to EPA as cited in the preamble in 51 FR 41329. Effective date: 10/29/90Reporting date: 12/27/90.Pursuant to section 8(d) of TSCA, EPA promulgated a model Health and Safety Data Reporting Rule. The section 8(d) model rule requires manufacturers, importers, and processors of listed chemical substances and mixtures to submit to EPA copies and lists of unpublished health and safety studies. Cyclohexane, 1,1'-methylenebis(4-isocyanato)- is included on this list. Effective date: 6/1/87

용도

개요

Methylene bis (4-cyclohexylisocyanate) (HMDI) (CAS No. 5124-30-1) is a clear to pale yellow liquid, which is soluble in acetone water and is incompatible with alcohols, amines, bases, acids, and may slowly polymerize if heated above 50 ℃. HMDI reacts with water and alcohol.

용도

HMDI has excellent light stability and the stability of the six membered ring structure, has excellent weather resistance and excellent mechanical properties of polyurethane material, and is especially suitable for the production of high performance elastic body, a water polyurethane resin and UV resin.

일반 설명

Clear colorless to light-yellow liquid.