P-톨릴-아세틸클로라이드

2-(4-Methylphenyl)acetyl chloride

HCID 2760634CAS 35675-44-6

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: Cc1ccc(CC(=O)Cl)cc1
InChIKey: QDZAWVLWIMOXJT-UHFFFAOYSA-N
분자식: C9H9ClO
평균 분자량: 168.62 g/mol
단동위원소 질량: 168.0341926

이름 및 식별자

우선 이름: 2-(4-Methylphenyl)acetyl chloride
IUPAC: 2-(4-methylphenyl)acetyl chloride
현지명: P-톨릴-아세틸클로라이드
영어명: P-TOLYL-ACETYL CHLORIDE
분자식: C9H9ClO
분자량: 168.62

이름 및 동의어

2-(4-methylphenyl)acetyl chlorideRefChem:458128673-227-135675-44-6P-Tolyl-Acetyl Chloridep-tolylacetyl chloridep-Tolyl-acetylchlorideMFCD00018813(4-methylphenyl)acetyl chloride4-methyl-phenyl-acetyl chloridestarbld00166734-methylphenylacetylchloride

이름 더 보기

P-톨릴-아세틸클로라이드p-Tolylacetylchloride,97+%Benzeneacetyl chloride, 4-methyl-

2-(p-tolyl)acetyl chloridep-methylphenylacetyl chloride2-(4-tolyl)acetyl chloride4-methylphenylacetyl chlorideSCHEMBL657538DTXSID90375274QDZAWVLWIMOXJT-UHFFFAOYSA-N2-(4-methylphenyl) acetylchloride

데이터베이스 식별자

CAS: 35675-44-6
PubChem CID: 2760634
DTXSID: DTXSID90375274
EC Number: 673-227-1
Nikkaji: J1.181.608H

물성

구조 계산 물성

XLogP: 2.8
극성 표면적: 17.1 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 1
회전 가능 결합 수: 2
무거운 원자 수: 11
형식 전하: 0
복잡도: 136

물리화학적 성질

끓는 점: 115 ℃/7.5mm · 115℃/7.5mm
물리적 상태: 액체
색상: 분홍색

안전 및 규제

GHS 분류

GHS Classification · 5건

Danger

H290 (16.7%): May be corrosive to metals [Warning Corrosive to Metals]；H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (16.7%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H314 (83.3%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]；H318 (50%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H332 (16.7%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H335 (16.7%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P234, P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P319, P321, P330, P362+P364, P363, P390, P403+P233, P405, P406, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 6 reports by companies from 5 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 CategoriesMet. Corr. 1 (16.7%)；Acute Tox. 4 (50%)；Acute Tox. 4 (16.7%)；Skin Corr. 1B (83.3%)；Eye Dam. 1 (50%)；Acute Tox. 4 (16.7%)；STOT SE 3 (16.7%)