2-Bromo-4-nitrotoluene

HCID 82189CAS 7745-93-9

기본 정보

표준 SMILES: Cc1ccc([N+](=O)[O-])cc1Br
InChIKey: XFZFJQHXWJIBQV-UHFFFAOYSA-N
분자식: C7H6BrNO2
평균 분자량: 216.03 g/mol
단동위원소 질량: 214.95819053

이름 및 식별자

우선 이름: 2-Bromo-4-nitrotoluene
IUPAC: 2-bromo-1-methyl-4-nitrobenzene
영어명: 2-Bromo-4-nitrotoluene
분자식: C7H6BrNO2
분자량: 216.03

이름 및 동의어

2-Bromo-4-nitrotoluene7745-93-92-Bromo-1-methyl-4-nitrobenzeneBenzene, 2-bromo-1-methyl-4-nitro-EINECS 231-809-9XFZFJQHXWJIBQV-UHFFFAOYSA-DTXSID20228163NSC 402166RefChem:466612DTXCID40150654231-809-9InChI=1/C7H6BrNO2/c1-5-2-3-6(9(10)11)4-7(5)8/h2-4H,1H3

이름 더 보기

NOLA-0162-Bromo-4-nitrotoLTIMTEC-BB SBB0078432-Bromo-4-nirotoluene4-Nitro-2-bromotoluene2-Bromo-4-nitrotoluene,98%2-Bromo-4-nitrotoluene >

MFCD00007195Toluene, 2-bromo-4-nitro-1-Bromo-2-methyl-5-nitrobenzene2-bromo-1-methyl-4-nitro-benzene3-Bromo-4-methylnitrobenzene3-bromo-4-methyl nitrobenzene3-bromo-4-methyl-1-nitrobenzeneNSC402166

데이터베이스 식별자

CAS: 7745-93-9
PubChem CID: 82189
DTXSID: DTXSID20228163
EC Number: 231-809-9
Nikkaji: J208.129F

물성

구조 계산 물성

XLogP: 3.2
극성 표면적: 45.8 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 2
회전 가능 결합 수: 0
무거운 원자 수: 11
형식 전하: 0
복잡도: 157

실험 및 물리화학적 성질

SpringerMaterials PropertiesCrystal structure

물리화학적 성질

녹는점: 76 · 76-77 °C(lit.)
끓는 점: 175 °C · 175 °C / 38mmHg
밀도: 1.6841 · 1.6841 (rough estimate)
굴절률: 1.612 · 1.6120 (estimate)
저장 조건: Sealed in dry,Room Temperature
용해도: soluble in Ether
물리적 상태: powder to crystal
색상: 흰색에서 갈색으로
BRN: 1941232 · 1941232
NIST: 2 · Benzene, 2-bromo-1-methyl-4-nitro-(7745-93-9)

화학적 성질

LIGHT YELLOW TO YELLOW CRYSTALLINE POWDER

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

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

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

Aggregated GHS information provided per 49 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 2건

Status: No longer Valid Update: 03-01-2019 https://echa.europa.eu/registration-dossier/-/registered-dossier/27328

2-Bromo-4-nitrotoluene: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and CategoriesAcute Tox. 4 (100%)

안전 데이터

wgk: 3
HS 번호: 29049090
risk_code: 22-36/37/38-20/21/22
hazard_code: Xn,Xi
safety_code: 36/37/39-26-22-24/25
위험 등급: IRRITANT

화학 및 산업

응용 분야

용도2-Bromo-4-nitrotoluene may be used industrially in organic synthesis, as a chemical intermediate or in the pharmaceutical industry.

상·하류 제품 정보

하류 제품

Benzene, 2-bromo-1-(dibromomethyl)-4-nitro-2-브로모-4-클로로톨루엔 2-Bromo-5-nitrotoluene 5-요오도-2-메틸벤조산 2-브로모-1-(브로모메틸)-4-니트로벤젠 벤조산,4-아미노-2-브로모-,메틸에스테르 2-브로모-4-니트로벤즈알데히드 2-Bromo-4-nitrobenzoic acid 메틸2-브로모-4-니트로벤조에이트 Methyl 5-nitro-2-methylbenzoate

공급사50 곳

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T&W GROUP021-61551611 13296011611 · [email protected]

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