CAS 24922-02-9 Ethyl 3-cyclopropyl-3-oxopropanoate (HCID 262979)

이름 및 식별자

우선 이름: Ethyl 3-cyclopropyl-3-oxopropanoate
IUPAC: ethyl 3-cyclopropyl-3-oxopropanoate
영어명: 3-Cyclopropyl-3-oxo-propionic acid ethyl ester
분자식: C8H12O3
분자량: 156.18

이름 및 동의어

ethyl 3-cyclopropyl-3-oxopropanoate24922-02-9DTXSID60294564RefChem:138690DTXCID10245703607-452-33-Cyclopropyl-3-oxo-propionic acid ethyl esterMFCD00184570Ethyl 3-cyclopropyl-3-oxopropionateethyl-3-cyclopropyl-3-oxopropanoateCYCLOPROPANEPROPANOIC ACID, BETA-OXO-, ETHYL ESTER3-Cyclopropyl-3-oxo-propionic aicd ethyl ester

이름 더 보기

Ethyl β-oxo-cyclopropanepropionateCarbethoxymethyl cyclopropyl ketone10Ethyl 3-cyclopropyl-3-oxopropanoateEthyl beta-oxo-Cyclopropane Propionateβ-Oxocyclopropanepropanoic athyl ester3-Cyclopropyl-3-oxo-propionicethyl esterEthyl 3-cyclopropyl-3-oxopropionate, 97%3-Cyclopropyl-3-oxopropionate ethyl esterβ-Oxocyclopropanepropanoic acid ethyl ester

Ethyl 3-cyclopropyl-3-oxo-propanoateNSC 97121249922-02-9NSC97121ethyl 3-cyclopropyl-3-oxo-propionateNCIOpen2_001813ethyl cyclopropylcarbonylacetateSCHEMBL1014646

데이터베이스 식별자

CAS: 24922-02-9
PubChem CID: 262979
DTXSID: DTXSID60294564
EC Number: 607-452-3
Nikkaji: J1.054.503J

물성

구조 계산 물성

XLogP: 0.7
극성 표면적: 43.4 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 3
회전 가능 결합 수: 5
무거운 원자 수: 11
형식 전하: 0
복잡도: 170

물리화학적 성질

끓는 점: 73 ℃/1mm · 73℃/1mm
밀도: 1.058 g/mL · 1.058 g/mL at 25 °C
굴절률: 20 · n20/D1.449
인화점: 96 ℃ · >96℃
저장 조건: Keep in dark place,Sealed in dry,Room Temperature
용해도: 클로로포름(약간 용해됨), 메탄올(약간 용해됨)
물리적 상태: 기름
산도 계수 (pKa): 10.61 · 10.61±0.20(Predicted)
색상: 무색
InChI: InChI=1S/C8H12O3/c1-2-11-8(10)5-7(9)6-3-4-6/h6H,2-5H2,1H3
InChIKey: LFSVADABIDBSBV-UHFFFAOYSA-N
SMILES: C1(CC1)C(=O)CC(=O)OCC

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

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

Aggregated GHS information provided per 7 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.