2-클로로-N-페네틸아세트아마이드

2-Chloro-N-phenethyl-acetamide

HCID 94921

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 13156-95-1
표준 SMILES: O=C(CCl)NCCc1ccccc1
InChIKey: LNWWGHNQLOXRTF-UHFFFAOYSA-N
분자식: C10H12ClNO
평균 분자량: 197.66 g/mol
단동위원소 질량: 197.0607417

이름 및 식별자

우선 이름: 2-Chloro-N-phenethyl-acetamide
IUPAC: 2-chloro-N-(2-phenylethyl)acetamide
현지명: 2-클로로-N-페네틸아세트아마이드
영어명: 2-CHLORO-N-PHENETHYLACETAMIDE
분자식: C10H12ClNO
분자량: 197.66

이름 및 동의어

2-Chloro-N-phenethyl-acetamideRefChem:470342695-978-42-Chloro-N-phenethylacetamide13156-95-12-Chloro-N-(2-phenylethyl)acetamideAcetamide, 2-chloro-N-phenethyl-MFCD00245084Acetamide, 2-chloro-N-(2-phenylethyl)-NSC-8377NSC 8377BRN 2102348

이름 더 보기

2-클로로-N-페네틸아세트아마이드SKL825AKOS B028817BUTTPARK 80\07-97AKOS BBS-00000816Praziquantel Impurity 162-chloro-n-phenethyl-acetamid

N-(2-PHENYLETHYL)CHLOROACETAMIDEN-phenethyl-2-chloroacetamideAI3-23562NSC8377Acetamide,2-chloro-N-(2-phenylethyl)-N-PhenethylchloroacetamideAG9HA2QS9JSCHEMBL696928

데이터베이스 식별자

CAS: 13156-95-1
PubChem CID: 94921
DTXSID: DTXSID10157110
ChEMBL: CHEMBL3244840
UNII: AG9HA2QS9J
EC Number: 695-978-4
Nikkaji: J810.666E

물성

구조 계산 물성

XLogP: 2.1
극성 표면적: 29.1 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 1
회전 가능 결합 수: 4
무거운 원자 수: 13
형식 전하: 0
복잡도: 155

물리화학적 성질

녹는점: 67 · 67-70°C
끓는 점: 186 · 186-189 °C(Press: 14 Torr)
밀도: 1.145 · 1.145±0.06 g/cm3(Predicted)
저장 조건: 2 · 2-8°C
물리적 상태: 고체
산도 계수 (pKa): 13.94 · 13.94±0.46(Predicted)

안전 및 규제

GHS 분류

GHS Classification · 5건

Danger

H301 (50%): Toxic if swallowed [Danger Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (50%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H319 (50%): 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, P270, P271, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 2 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.