Bitolylene diisocyanate (HCID 7072)

이름 및 식별자

우선 이름: Bitolylene diisocyanate
IUPAC: 1-isocyanato-4-(4-isocyanato-3-methylphenyl)-2-methylbenzene
현지명: 4,4""-디이소시아나토-3,3""-디메틸-1,1""-비페닐
영어명: 3,3'-Dimethyl-4,4'-biphenylene diisocyanate
분자식: C16H12N2O2
분자량: 264.28

이름 및 동의어

91-97-44,4'-Diisocyanato-3,3'-dimethylbiphenylBitolylene diisocyanate3,3'-Dimethyl-4,4'-biphenylene diisocyanateNacconate 2003,3'-Dimethyl-4,4'-diphenylene diisocyanate3,3'-Bitolylene-4,4'-diisocyanate1,1'-BIPHENYL, 4,4'-DIISOCYANATO-3,3'-DIMETHYL-3,3'-Dimethylbiphenyl 4,4'-diisocyanate4,4'-Diisocyanato-3,3'-bitolylNSC 9599CCRIS 8907

이름 더 보기

3,3'-다이메틸바이페닐-4,4'-다이일다이아이소사이아네이트4,4""-디이소시아나토-3,3""-디메틸-1,1""-비페닐4,4'-디이소시아나토-3,3'-디메틸-1,1'-비페닐3,3'-다이메틸바이페닐-4,4'-다이일 다이아이소사이아네이트3,3'-다이메틸-4,4'-다이페닐렌 다이아이소사이아네이트3,3'-다이메틸-4,4'-바이페닐렌 다이아이소사이아네이트3,3'-다이메틸-4,4'-바이페닐렌 아이소사이아네이트3,3'-다이메틸다이페닐 4,4'-다이아이소사이아네이트3,3'-다이메틸바이페닐 4,4'-다이아이소사이아네이트4,4'-다이아이소사이아네이토-3,3'-다이메틸-1,1'-바이페닐4,4'-다이아이소사이아네이토-3,3'-다이메틸바이페닐4,4'-다이아이소사이아네이토-3,3'-바이톨릴톨리딘 다이아이소사이아네이트3,3'-디메틸-4,4'-비페닐렌디이소시아네이트TODInacconate2003,3'-DIMETHYL-4-diyl diisocyanate3,3'-Dimethyl-4,4'-btolidinediisocyanatebitoluenediisocyanatebitolylenediisocyanateo-Tolidine diisocyanate-dimethylbiphenyl-4,4'

3,3'-Dimethyl-4,4'-biphenylene isocyanateEINECS 202-112-7UNII-9L950NB0HN3,3'-Dimethyl-4,4'-biphenylylene diisocyanateBRN 27437109L950NB0HNIsocyanic acid, 3,3'-dimethyl-4,4'-biphenylene esterNSC-9599

데이터베이스 식별자

CAS: 91-97-4
PubChem CID: 7072
DTXSID: DTXSID7041463
UNII: 9L950NB0HN
EC Number: 202-112-7
Nikkaji: J41.830G

물성

구조 계산 물성

XLogP: 5.9
극성 표면적: 58.9 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 4
회전 가능 결합 수: 3
무거운 원자 수: 20
형식 전하: 0
복잡도: 384

실험 및 물리화학적 성질

Endocrine DisruptorsPotential endocrine disrupting compound

Food Contact Substances · 2건

FCS -> FDA Cumulative Estimated Daily Intake (CEDI)

FCS -> FDA Inventory of Food Contact Substances Listed in 21 CFR

물리화학적 성질

녹는점: 70 · 70-72°C
끓는 점: 195 · 195-197°C (667 Pa)
밀도: 1.197 · 1.197 (80°C)
증기압: 0.003 Pa · 0.003Pa at 25℃
굴절률: 1.58 · 1.5800 (estimate)
인화점: 218 °C · 218°C
저장 조건: 0 · 0-10°C
용해도: 톨루엔에 용해됨
물리적 상태: 작은 공
색상: 흰색에서 거의 흰색
수용성: 594.08 μg/L · 594.08μg/L at 25℃
LogP: 6.052 at · 6.052 at 25℃
EPA: 3 · 3,3'-Dimethyl-4,4'-diphenylene diisocyanate (91-97-4)

안전 및 규제

GHS 분류

GHS Classification · 6건

Danger

H317: May cause an allergic skin reaction [Warning Sensitization, Skin]

P203, P233, P260, P261, P271, P272, P280, P284, P302+P352, P304+P340, P318, P321, P333+P317, P342+P316, P362+P364, P403, P405, and P501 (click each P-code to see the statement)

Danger

H317 (98.7%): May cause an allergic skin reaction [Warning Sensitization, Skin]

P233, P260, P261, P271, P272, P273, P280, P284, P302+P352, P304+P340, P317, P321, P333+P317, P342+P316, P362+P364, P391, P403, and P501 (click each P-code to see the statement)

유해성 정보

Regulatory Information · 4건

Chemical: 1,1'-Biphenyl, 4,4'-diisocyanato-3,3'-dimethyl-

Hazard Traits - Respiratory Toxicity

Status: Active Update: 11-01-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/10067

Restricted substance: 3,3'-dimethylbiphenyl-4,4'-diyl diisocyanate

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 · 1건

Isocyanates and thioisocyanates, such as 3,3'-DIMETHYL-4,4'-DIPHENYLENE DIISOCYANATE, 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)].

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
rtecs: DV3960000
HS 번호: 29291090
기존화학 물질: 2009-1-587
함량 및 규제정보: 물질구분: 유독물질; 혼합물(제품)함량정보: 4,4'-디이소시아나토-3,3'-디메틸-1,1'-비페닐 및 이를 25% 이상 함유한 혼합물
유해화학물질 필터링: 2009-1-587

화학 및 산업

용도 및 제조

General Manufacturing Information1,1'-Biphenyl, 4,4'-diisocyanato-3,3'-dimethyl-: ACTIVE

응용 분야

용도4,4''-Diisocyanato-3,3''-dimethylbiphenyl is used in preparation method of high-thixotropy single-component modified silane polymer sealant comprising thixotropic agent.

공급사50 곳

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

衢州润东化工有限公司0570-8789886 18892685668 · [email protected]

湖北永阔科技有限公司027-59223108 15972152991 · [email protected]

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

湖北万得化工有限公司15377098680 15377098680 · [email protected]

연결된 노트

불러오는 중…

4,4""-디이소시아나토-3,3""-디메틸-1,1""-비페닐

기본 정보