Chloro-N,N-diethylacetamide (HCID 16844)

이름 및 식별자

우선 이름: Chloro-N,N-diethylacetamide
IUPAC: 2-chloro-N,N-diethylacetamide
현지명: N-클로로아세틸디에틸아민
영어명: 2-Chloro-N,N-diethylacetamide
분자식: C6H12ClNO
분자량: 149.62

이름 및 동의어

2-Chloro-N,N-diethylacetamide2315-36-8N,N-DiethylchloroacetamideAcetamide, 2-chloro-N,N-diethyl-N,N-Diethyl-2-chloroacetamidealpha-Chloro-N,N-diethylacetamide2TK444LD3SN,N-diethyl-alpha-chloroacetamideNSC-1726DTXSID7062326CHLORO-N,N-DIETHYLACETAMIDERefChem:86381

이름 더 보기

N-클로로아세틸디에틸아민N-클로로아세틸디에틸아민(N-CHLOROACETYLDIETHYLAMINE)CDEAtl83WLN: G1VN2&2Caswell No. 333GAKOS BBS-00000866N-diethylacetaMideN,N-Diethyl-2-chloroLABOTEST-BB LT00787906MONOMETHYLFORMAMIDE TECH

DTXCID3036818219-019-2N-ChloroacetyldiethylamineTL 83NSC 1726Diethylamid kyseliny chloroctove2-chloro-N,N-diethyl-acetamide.alpha.-Chloro-N,N-diethylacetamide

데이터베이스 식별자

CAS: 2315-36-8
PubChem CID: 16844
DTXSID: DTXSID7062326
UNII: 2TK444LD3S
EC Number: 219-019-2
Nikkaji: J7.396B

물성

구조 계산 물성

XLogP: 1.1
극성 표면적: 20.3 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 1
회전 가능 결합 수: 3
무거운 원자 수: 9
형식 전하: 0
복잡도: 91.1

실험 및 물리화학적 성질

SpringerMaterials PropertiesDielectric constant

물리화학적 성질

녹는점: 58 °C · 58 °C
끓는 점: 121 · 121-122 °C (12 mmHg)
밀도: 1.089 g/mL · 1.089 g/mL at 25 °C(lit.)
굴절률: 1.469 · 1.469-1.471
인화점: 110 °C · >110°C
저장 조건: 30 °C · Store below +30°C.
용해도: 85.5 g/L · 85.5g/L
물리적 상태: 액체 또는 고체
산도 계수 (pKa): -0.95 · -0.95±0.70(Predicted)
Specific Gravity: 1.089 · 1.089
색상: 무색투명~연황색
수용성: 녹는
BRN: 605866 · 605866
주요 응용: 농업환경
InChI: 1S/C6H12ClNO/c1-3-8(4-2)6(9)5-7/h3-5H2,1-2H3
InChIKey: CQQUWTMMFMJEFE-UHFFFAOYSA-N
SMILES: CCN(CC)C(=O)CCl
NIST: 2 · Acetamide, 2-chloro-N,N-diethyl-(2315-36-8)
EPA: 2 · Acetamide, 2-chloro-N,N-diethyl- (2315-36-8)

화학적 성질

clear brown liquid

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H302 (91.1%): Harmful if swallowed [Warning Acute toxicity, oral]

P260, P261, P262, P264, P264+P265, P270, P271, P280, P284, P301+P317, P302+P352, P304+P340, P305+P351+P338, P316, P319, P320, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 45 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory InformationAcetamide, 2-chloro-N,N-diethyl-: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and CategoriesAcute Tox. 4 (91.1%)

안전 데이터

wgk: 3
tsca: TSCA listed
rtecs: AB5425000
ridadr: 2810
독성: LD50 orally in Rabbit: 500 mg/kg LD50 dermal Rat 980 mg/kg
HS 번호: 29241900
risk_code: 36/37/38-26-21/22-20/21/22-38-11
hazard_code: T+,Xn,Xi,F
safety_code: 45-38-36/37/39-28A-26-28-36-16
포장분류: III
위험 등급: 6.1
Hazard Classifications: Acute Tox. 1 InhalationAcute Tox. 3 DermalAcute Tox. 4 OralEye Irrit. 2Skin Irrit. 2STOT SE 3
스토리지 클래스: 6.1A - Combustible acute toxic Cat. 1 and 2very toxic hazardous materials

화학 및 산업

용도 및 제조

General Manufacturing InformationAcetamide, 2-chloro-N,N-diethyl-: ACTIVE

응용 분야 · 1건

용도2-Chloro-N,N-diethylacetamide has been used in:preparation of calixarene amidessynthesis of 5-bromo-25,26,27,28-tetrakis[(N,N-diethylaminocarbonyl)-methoxy]calix[4]arenesynthesis of amide calix[4]pyrrole macrocycles with super-extended cavitiesmicrowave-assisted organic synthesis of 3-cyano-N,N-diethyl-4-(4-methoxyphenoyl)-4-oxobutanamide