9-(Chloromethyl)anthracene (HCID 32385)

이름 및 식별자

우선 이름: 9-(Chloromethyl)anthracene
IUPAC: 9-(chloromethyl)anthracene
영어명: 9-(Chloromethyl)anthracene
분자식: C15H11Cl
분자량: 226.7

이름 및 동의어

9-(Chloromethyl)anthracene24463-19-29-ChloromethylanthraceneAnthracene, 9-(chloromethyl)-8C4ZDD4KUVANTHRACENE, 9-CHLOROMETHYL-NSC-241165DTXSID00179220RefChem:107700DTXCID30101711246-274-79-Anthracenylmethyl chloride

이름 더 보기

icr4489-Chlormethyl-anthracen9-chloromethyl-anthracen9-(choromethyl)anthracene9-(chloroMethyl)antracene(9-Anthrylmethyl) chloride(9-Anthryl)methyl chloride

C15H11ClMFCD00001263ICR 4489-ChloromethyanthraceneCCRIS 7993EINECS 246-274-79-chloromethyl-anthraceneNSC 241165

데이터베이스 식별자

CAS: 24463-19-2
PubChem CID: 32385
DTXSID: DTXSID00179220
ChEMBL: CHEMBL1446266
UNII: 8C4ZDD4KUV
EC Number: 246-274-7
Nikkaji: J3.795H

물성

구조 계산 물성

XLogP: 5.1
극성 표면적: 0 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 0
회전 가능 결합 수: 1
무거운 원자 수: 16
형식 전하: 0
복잡도: 216

물리화학적 성질

녹는점: 138 · 138-140 °C (lit.)
끓는 점: 294.66 °C · 294.66°C (rough estimate)
밀도: 1.151 · 1.1510 (rough estimate)
굴절률: 1.6281 · 1.6281 (estimate)
저장 조건: 2 · under inert gas (nitrogen or Argon) at 2–8 °C
용해도: 클로로포름: 용해성
물리적 상태: 가루
색상: 노란색
수용성: 클로로포름에 용해됩니다. 물에 불용성.
BRN: 1873394 · 1873394
InChI: InChI=1S/C15H11Cl/c16-10-15-13-7-3-1-5-11(13)9-12-6-2-4-8-14(12)15/h1-9H,10H2
InChIKey: PCVRSXXPGXRVEZ-UHFFFAOYSA-N
SMILES: C1=C2C(C=C3C(=C2CCl)C=CC=C3)=CC=C1
NIST: 9 · 9-(Chloromethyl)anthracene(24463-19-2)

화학적 성질

YELLOW POWDER

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H314 (16.7%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P260, P261, P264, P264+P265, P271, P280, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P319, P321, P332+P317, P337+P317, P362+P364, P363, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 48 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory InformationAnthracene, 9-(chloromethyl)-: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and CategoriesSkin Corr. 1B (16.7%)

안전 데이터

wgk: 3
rtecs: CA9600000
ridadr: UN 3261 8/PG 2
독성: mouse,LDLo,intravenous,2267ug/kg (2.267mg/kg),Cancer Research. Vol. 36, Pg. 2423, 1976.
HS 번호: 29039990
risk_code: 36/37/38
hazard_code: Xi
safety_code: 26-36
포장분류: III
위험 등급: 8
F 고인화성물질: 19
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2STOT SE 3
스토리지 클래스: 8A - Combustible corrosive hazardous materials

화학 및 산업

응용 분야 · 1건

용도9-(Chloromethyl)anthracene is used as a blocking group reagent used for carboxylic acids, phenols, mercaptans and thiophenols. It is a derivatizing agent for carboxylic acids giving esters with enhanced UV and fluorescence detection in HPLC.