3,5-BIS(트리플루오로메틸)-1,2-디아미노벤젠

1,2-Diamino-3,5-bis(trifluoromethyl)benzene

HCID 2773214

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 367-65-7
표준 SMILES: Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1N
InChIKey: BRLIJPMFMGTIAW-UHFFFAOYSA-N
분자식: C8H6F6N2
평균 분자량: 244.14 g/mol
단동위원소 질량: 244.04351751

이름 및 식별자

우선 이름: 1,2-Diamino-3,5-bis(trifluoromethyl)benzene
IUPAC: 3,5-bis(trifluoromethyl)benzene-1,2-diamine
현지명: 3,5-BIS(트리플루오로메틸)-1,2-디아미노벤젠
영어명: 3,5-Bis(trifluoromethyl)-1,2-diaminobenzene
분자식: C8H6F6N2
분자량: 244.14

이름 및 동의어

1,2-DIAMINO-3,5-BIS(TRIFLUOROMETHYL)BENZENERefChem:411499670-794-7367-65-73,5-Bis(trifluoromethyl)-1,2-diaminobenzene3,5-bis(trifluoromethyl)benzene-1,2-diamineMFCD016314303,5-Bis(trifluoromethyl)-1,2-phenylenediamine3,5-Bis(trifluoromethyl)benzene-1,2dianiline3,5-Bis(trifluoromethyl)-o-phenylenediamine1,2-Benzenediamine, 3,5-bis(trifluoromethyl)-SCHEMBL205002

이름 더 보기

3,5-BIS(트리플루오로메틸)-1,2-디아미노벤젠3,5-Bis(trifluoromethyl)phenylen3,5-Bis(trifluoromethyl)-1,2-diam3,5-Bis(trifluoromethyl)phenylene-1,2-diamine

DTXSID50378286SBB099812AKOS005259773DS-0939SY03140035-Bis(trifluoromethyl)-12-diaminobenzeneDB-021969CS-0128720

데이터베이스 식별자

CAS: 367-65-7
PubChem CID: 2773214
DTXSID: DTXSID50378286
EC Number: 670-794-7

물성

구조 계산 물성

XLogP: 2.3
극성 표면적: 52 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 8
회전 가능 결합 수: 0
무거운 원자 수: 16
형식 전하: 0
복잡도: 248

물리화학적 성질

녹는점: 42 · 42-44°C
끓는 점: 228.2 · 228.2±40.0 °C(Predicted)
밀도: 1.516 · 1.516±0.06 g/cm3(Predicted)
저장 조건: Keep in dark place,Sealed in dry,Room Temperature
산도 계수 (pKa): 1.72 · 1.72±0.10(Predicted)
물리적 상태: solid
수용성: 물에 불용성.
BRN: 3344332 · 3344332
InChI: 1S/C8H6F6N2/c9-7(10,11)3-1-4(8(12,13)14)6(16)5(15)2-3/h1-2H,15-16H2
InChIKey: BRLIJPMFMGTIAW-UHFFFAOYSA-N
SMILES: FC(F)(F)c1c(c(cc(c1)C(F)(F)F)N)N

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P262, P264, P264+P265, P270, P271, P280, 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 8 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazard Classes and CategoriesAcute Tox. 4 (100%)

안전 데이터

wgk: WGK 3
ridadr: 2811
HS 번호: 2921599090
risk_code: 20/21/22-36/37/38-36
hazard_code: T
safety_code: 26-36/37/39
포장분류: III
위험 등급: 6.1
위험 참고 사항: Toxic
Hazard Classifications: Acute Tox. 4 OralEye Irrit. 2
스토리지 클래스: 11 - Combustible Solids

화학 및 산업

응용 분야

용도It is applied as an active pharmaceutical intermediate.

공급사47 곳

毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]

Changzhou Anxuan Chemical Co., Ltd+86-0519-89882563 +86-18961279162 · [email protected]

温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]

Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]

Aladdin Scientific[email protected]

화합물 노트

불러오는 중…