3,5-Dimethylisoxazole-4-isocyanate

HCID 2736266CAS 131825-41-7
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
Cc1noc(C)c1N=C=O
InChIKey
JJQYAGYVYNMYGE-UHFFFAOYSA-N
분자식
C6H6N2O2
평균 분자량
138.12 g/mol
단동위원소 질량
138.04292743

이름 및 식별자

우선 이름
3,5-Dimethylisoxazole-4-isocyanate
IUPAC
4-isocyanato-3,5-dimethyl-1,2-oxazole
영어명
3,5-Dimethylisoxazol-4-yl isocyanate
분자식
C6H6N2O2
분자량
138.12

이름 및 동의어

3,5-Dimethylisoxazole-4-isocyanateRefChem:487039641-351-5131825-41-73,5-Dimethylisoxazol-4-yl isocyanate4-isocyanato-3,5-dimethyl-1,2-oxazole4-isocyanato-3,5-dimethylisoxazole3,5-Dimethylisoxazol-4-ylisocyanateMFCD001199103,5-dimethylisoxazole-4-yl isocyanateIsoxazole, 4-isocyanato-3,5-dimethyl-4-isocyanato-3,5-dimethyl-isoxazole
이름 더 보기
BUTTPARK 154\15-634-Isocyanoto-3,5-dimethyl-isoxazole3,5-Dimethylisoxazole-4-ylisocyanate3,5-Dimethylisoxazole-4-isocyanate 97%3,5-Dimethylisoxazole-4-ylisocyanate97%
Isoxazole,4-isocyanato-3,5-dimethyl-3,5-Dimethyl-4-isocyanatoisoxazole3,5-dimethyl isoxazol-4-yl isocyanate3,5-Dimethyl-4-isocyanato-1,2-oxazoleSCHEMBL635055DTXSID603712433,5-dimethylisoxazol-4-isocyanate4-isocyanato3,5-dimethyl-isoxazole

데이터베이스 식별자

CAS
131825-41-7
PubChem CID
2736266
DTXSID
DTXSID60371243
EC Number
641-351-5

물성

구조 계산 물성

XLogP
2
극성 표면적
55.5 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
4
회전 가능 결합 수
1
무거운 원자 수
10

물리화학적 성질

끓는 점
96 · 96-98°C 15mm

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H301 (33.3%): Toxic if swallowed [Danger Acute toxicity, oral]

P261, P262, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 3 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazard Classes and CategoriesAcute Tox. 4 (66.7%)

안전 데이터

ridadr
2206
HS 번호
2929100090
risk_code
20/21/22-36/37/38
hazard_code
Xi
safety_code
26-36/37/39
위험 참고 사항
Irritant

화학 및 산업

상·하류 제품 정보

공급사20 곳

韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
宝鸡缔都医药化工有限公司029-81145305 17791533577 · [email protected]
赛默飞世尔科技（中国）有限公司800-810-5118 · [email protected]

관련 반응

43건
반응 기록 만들기

연결된 노트

불러오는 중…