3-Methoxy-5-nitroaniline

HCID 2759598

기본 정보

CAS
586-10-7
표준 SMILES
COc1cc(N)cc([N+](=O)[O-])c1
InChIKey
BGWUXZLHDLNYHW-UHFFFAOYSA-N
분자식
C7H8N2O3
평균 분자량
168.15 g/mol
단동위원소 질량
168.05349212

이름 및 식별자

우선 이름
3-Methoxy-5-nitroaniline
IUPAC
3-methoxy-5-nitroaniline
영어명
3-METHOXY-5-NITROANILINE
분자식
C7H8N2O3
분자량
168.15

이름 및 동의어

3-methoxy-5-nitroaniline586-10-7DTXSID70374861RefChem:503175DTXCID50325891672-085-83-methoxy-5-nitro-phenylamine(3-methoxy-5-nitrophenyl)amine3-methoxy-5-nitrophenylamineMFCD01103799benzenamine, 3-methoxy-5-nitro-aniline, 3-methoxy-5-nitro-
이름 더 보기
CHEMBRDG-BB 4009255(3-methoxy-5-nitrophenyl)amine(SALTDATA: FREE)
3-methoxy-5-nitro-aniline5-Nitro-m-anisidine3-Amino-5-nitroanisolSCHEMBL189811AKOS BB-9261SCHEMBL31118853AKOS B014360ART-CHEM-BB B014360

데이터베이스 식별자

CAS
586-10-7
PubChem CID
2759598
DTXSID
DTXSID70374861
EC Number
672-085-8
Nikkaji
J154.689I

물성

구조 계산 물성

XLogP
2
극성 표면적
81.1 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
4
회전 가능 결합 수
1
무거운 원자 수
12

물리화학적 성질

녹는점
117 · 117-119 °C
끓는 점
365.3 · 365.3±22.0 °C(Predicted)
밀도
1.318 · 1.318±0.06 g/cm3(Predicted)
저장 조건
2 · 2-8°C(protect from light)
산도 계수 (pKa)
2.1 · 2.10±0.10(Predicted)
물리적 상태
가루

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral];H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal];H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation];H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

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 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

유해성 정보

Hazard Classes and CategoriesAcute Tox. 4 (100%);Acute Tox. 4 (100%);Skin Irrit. 2 (100%);Eye Irrit. 2A (100%);Acute Tox. 4 (100%);STOT SE 3 (100%)

안전 데이터

HS 번호
2922290090
위험 등급
IRRITANT

화학 및 산업

공급사29 곳

Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]
南京世洲生物科技有限公司025-025-85560043 17301488900 · [email protected]
郑州鸿晟医药科技有限公司0371-55695890 15637198702 · [email protected]
毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]

관련 반응

16건

화합물 노트

불러오는 중…