1,1-디이소프로폭시트리메틸아민

N,N,N-trimethyl-1,1-bis(1-methylethoxy)amine

HCID 87682CAS 18503-89-4

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: CC(C)OC(OC(C)C)N(C)C
InChIKey: XOZZATXWQMOVHL-UHFFFAOYSA-N
분자식: C9H21NO2
평균 분자량: 175.27 g/mol
단동위원소 질량: 175.15722891

이름 및 식별자

우선 이름: N,N,N-trimethyl-1,1-bis(1-methylethoxy)amine
IUPAC: N,N-dimethyl-1,1-di(propan-2-yloxy)methanamine
현지명: 1,1-디이소프로폭시트리메틸아민
영어명: N,N-Dimethylformamide diisopropyl acetal
분자식: C9H21NO2
분자량: 175.27

이름 및 동의어

18503-89-4N,N-Dimethyl-1,1-bis(1-methylethoxy)methanamineN,N,N-Trimethyl-1,1-bis(1-methylethoxy)amineEINECS 242-386-5DTXSID20171701RefChem:822078DTXCID6094192242-386-5N,N-Dimethylformamide diisopropyl acetal1,1-diisopropoxy-n,n-dimethylmethanamineN,N-dimethyl-1,1-di(propan-2-yloxy)methanamineMFCD00008879

이름 더 보기

1,1-디이소프로폭시트리메틸아민SKL1154diisopropoxymethyl(dimethyl)aminediisopropoxy-N,N-dimethylmethanamine1,1‐Bis‐(1‐methylethoxy)‐trimethylamineN,N-DIMETHYLFORMAMIDE DI-N-PROPYL ACETAL

Methanamine, N,N-dimethyl-1,1-bis(1-methylethoxy)-[bis(propan-2-yloxy)methyl]dimethylaminedimethylformamide diisopropylacetal1,1-Diisopropoxytrimethylamine1,1-Diisopropoxy-N,N-dimethylmethylamineDimethyl(diisopropoxymethyl)amineDMF diisopropyl acetalN,N-DIMETHYLFORMAMIDE DIMETHYLACETATE

데이터베이스 식별자

CAS: 18503-89-4
PubChem CID: 87682
DTXSID: DTXSID20171701
UNII: NZF48578HE
EC Number: 242-386-5
Nikkaji: J149.893B

물성

구조 계산 물성

XLogP: 1.8
극성 표면적: 21.7 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 3
회전 가능 결합 수: 5
무거운 원자 수: 12
형식 전하: 0
복잡도: 103

물리화학적 성질

끓는 점: 79 · 79-80 °C60 mm Hg(lit.)
밀도: 0.838 g/mL · 0.838 g/mL at 25 °C(lit.)
굴절률: 20 · n20/D 1.409(lit.)
인화점: 74 °F · 74 °F
저장 조건: -20 °C, · -20°C, protect from light
물리적 상태: liquid
산도 계수 (pKa): 5.47 · 5.47±0.50(Predicted)
BRN: 1901978 · 1901978
InChI: InChI=1S/C9H21NO2/c1-7(2)11-9(10(5)6)12-8(3)4/h7-9H,1-6H3
InChIKey: XOZZATXWQMOVHL-UHFFFAOYSA-N
SMILES: C(OC(C)C)(OC(C)C)N(C)C

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazard Classes and CategoriesFlam. Liq. 3 (100%)

안전 데이터

wgk: 3
ridadr: UN 1993 3/PG 3
HS 번호: 2922190090
risk_code: 36/37/38-10
hazard_code: Xi
safety_code: 26-36
포장분류: III
위험 등급: 3.2
Hazard Classifications: Eye Irrit. 2Flam. Liq. 3Skin Irrit. 2STOT SE 3
스토리지 클래스: 3 - Flammable liquids

화학 및 산업

응용 분야

용도N,N-Dimethylformamide diisopropyl acetal was used in the quantification of cocaine and its metabolite, benzoyl ecgonine from urine matrix.

상·하류 제품 정보

상류 원료

공급사50 곳

山东玖玥生物科技有限公司15553333686

上海康恩博医药科技有限公司17510465506 · [email protected]

国药集团化学试剂有限公司86-21-63210123 · [email protected]

宁波君龙新材料有限公司0574 88552216 19032109277 · [email protected]

毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]

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