2-플루오로-5-하이드록시벤젠카보니트릴

2-Fluoro-5-hydroxybenzonitrile

HCID 22612410

기본 정보

CAS
104798-53-0
표준 SMILES
N#Cc1cc(O)ccc1F
InChIKey
HFLYBTRQFOKYHC-UHFFFAOYSA-N
분자식
C7H4FNO
평균 분자량
137.11 g/mol
단동위원소 질량
137.02769191

이름 및 식별자

우선 이름
2-Fluoro-5-hydroxybenzonitrile
IUPAC
2-fluoro-5-hydroxybenzonitrile
현지명
2-플루오로-5-하이드록시벤젠카보니트릴
영어명
2-Fluoro-5-hydroxybenzenecarbonitrile
분자식
C7H4FNO
분자량
137.11

이름 및 동의어

104798-53-02-Fluoro-5-hydroxybenzonitrileDTXSID40626920RefChem:260986DTXCID70577673642-753-32-FLUORO-5-HYDROXYBENZENECARBONITRILE3-Cyano-4-fluorophenolMFCD11846514Benzonitrile, 2-fluoro-5-hydroxy-SCHEMBL1895172-fluoro-5-hydroxy-benzonitrile
이름 더 보기
2-플루오로-5-하이드록시벤젠카보니트릴2-Fluoro-5-hydroxybenzeneFluoro-5-hydroxybenzonitrile2-Fluoro-5-hydroxybenzonitrile 98%
AKOS005073272KD-0765AC-28611SY0318492-fluoro-5-hydroxy-beFT-0659075A801062SCHEMBL4466578

데이터베이스 식별자

CAS
104798-53-0
PubChem CID
22612410
DTXSID
DTXSID40626920
EC Number
642-753-3

물성

구조 계산 물성

XLogP
1.4
극성 표면적
44 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
3
회전 가능 결합 수
0
무거운 원자 수
10

물리화학적 성질

녹는점
111 · 111-113°
끓는 점
268 ℃ · 268℃
밀도
1.34 · 1.34
인화점
116 ℃ · 116℃
저장 조건
Inert atmosphere,Room Temperature
물리적 상태
고체

화학적 성질

off-white crytalline

안전 및 규제

GHS 분류

GHS Classification · 5건

Danger

H301+H311+H331 (20%): Toxic if swallowed, in contact with skin or if inhaled [Danger Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation];H301 (40%): Toxic if swallowed [Danger Acute toxicity, oral];H302 (40%): Harmful if swallowed [Warning Acute toxicity, oral];H311 (40%): Toxic in contact with skin [Danger Acute toxicity, dermal];H312 (40%): Harmful in contact with skin [Warning Acute toxicity, dermal];H315 (80%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (80%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H331 (20%): Toxic if inhaled [Danger Acute toxicity, inhalation];H332 (40%): Harmful if inhaled [Warning Acute toxicity, inhalation];H335 (80%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

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 5 reports by companies from 4 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. 3 (40%);Acute Tox. 4 (40%);Acute Tox. 3 (40%);Acute Tox. 4 (40%);Skin Irrit. 2 (80%);Eye Irrit. 2 (80%);Acute Tox. 3 (20%);Acute Tox. 4 (40%);STOT SE 3 (80%)

안전 데이터

HS 번호
2926907090
위험 등급
IRRITANT

화학 및 산업

공급사98 곳

Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
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]
天津瑞德法莫科技有限公司13821803402 · [email protected]
南京楷煜医药科技有限公司025-86160631; 18913801556 · [email protected]

관련 반응

6건

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