CAS 62600-71-9 (R)-(+)-3-Chlorostyrene oxide (HCID 10898919)

이름 및 식별자

우선 이름: (R)-(+)-3-Chlorostyrene oxide
IUPAC: (2R)-2-(3-chlorophenyl)oxirane
영어명: (R)-3-Chlorostyrene oxide
분자식: C8H7ClO
분자량: 154.59

이름 및 동의어

62600-71-9(R)-(+)-3-Chlorostyrene oxideDTXSID301335382RefChem:406982DTXCID501765137613-060-3(R)-2-(3-Chlorophenyl)oxirane(2R)-2-(3-chlorophenyl)oxirane(R)-3-Chlorostyrene oxide(R)-(+)-(3-Chlorophenyl)oxiraneMFCD00673317Oxirane, (3-chlorophenyl)-, (2R)-

이름 더 보기

TB-1922CgHzCIO?-(3-Chlorophenyl)oxide(R)-(3-CHLOROPHENYL)OXIDE(R)-M-CHLOROSTYRENE OXIDE(R)-(3-CHLOROPHENYL)OXIRANER(+)-(3-CHLOROPHENYL)OXIRANE

(R)-3-chlorophenyl oxirane(R)-m-chloro-styrene oxideSCHEMBL1947272(R)-(-)-3-chlorostyrene oxideYVMKRPGFBQGEBF-QMMMGPOBSA-N(R)-2-(3-chlorophenyl)-oxirane(2R)-2-(3-chlorophenyl)-oxiraneSBB064283

데이터베이스 식별자

CAS: 62600-71-9
PubChem CID: 10898919
DTXSID: DTXSID301335382
EC Number: 613-060-3
Nikkaji: J918.458I

물성

구조 계산 물성

XLogP: 2
극성 표면적: 12.5 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 1
회전 가능 결합 수: 1
무거운 원자 수: 10
형식 전하: 0
복잡도: 126

물리화학적 성질

녹는점: 54 · 54-56 °C
끓는 점: 67 · 67-68 °C1 mm Hg(lit.)
밀도: 1.217 g/mL · 1.217 g/mL at 20 °C(lit.)
굴절률: 20 · n20/D 1.551
인화점: 207 °F · 207 °F
저장 조건: Store under Nitrogen
물리적 상태: liquid
BRN: 3588590 · 3588590
InChI: 1S/C8H7ClO/c9-7-3-1-2-6(4-7)8-5-10-8/h1-4,8H,5H2/t8-/m0/s1
InChIKey: YVMKRPGFBQGEBF-QMMMGPOBSA-N
SMILES: Clc1cccc(c1)[C@@H]2CO2

안전 및 규제

GHS 분류

GHS Classification · 5건

Danger

H301 (72.7%): Toxic if swallowed [Danger Acute toxicity, oral]；H314 (72.7%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]；H315 (27.3%): Causes skin irritation [Warning Skin corrosion/irritation]；H317 (27.3%): May cause an allergic skin reaction [Warning Sensitization, Skin]；H318 (72.7%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H319 (27.3%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (27.3%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]；H341 (72.7%): Suspected of causing genetic defects [Warning Germ cell mutagenicity]；H411 (72.7%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]

P203, P260, P261, P264, P264+P265, P270, P271, P272, P273, P280, P301+P316, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P318, P319, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P363, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 143 reports by companies from 3 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 (72.7%)；Skin Corr. 1A (72.7%)；Skin Irrit. 2 (27.3%)；Skin Sens. 1 (27.3%)；Eye Dam. 1 (72.7%)；Eye Irrit. 2 (27.3%)；STOT SE 3 (27.3%)；Muta. 2 (72.7%)；Aquatic Chronic 2 (72.7%)

안전 데이터

wgk: 3
HS 번호: 2932990090
risk_code: 36/37/38-43
hazard_code: Xi
safety_code: 26-36/37
F 고인화성물질: 10-21
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2Skin Sens. 1STOT SE 3
스토리지 클래스: 10 - Combustible liquids

화학 및 산업

응용 분야

용도(R)-(+)-3-Chlorostyrene oxide may be used as an intermediate for the synthesis of 4-aminopiperidine based human β3-adrenergic receptor (AR) agonists.