디메틸아미노아세트알데히드에틸아세탈

(2,2-Diethoxyethyl)dimethylamine

HCID 77163CAS 3616-56-6

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: CCOC(CN(C)C)OCC
InChIKey: SSFAUOAQOOISRQ-UHFFFAOYSA-N
분자식: C8H19NO2
평균 분자량: 161.24 g/mol
단동위원소 질량: 161.14157885

이름 및 식별자

우선 이름: (2,2-Diethoxyethyl)dimethylamine
IUPAC: 2,2-diethoxy-N,N-dimethylethanamine
현지명: 디메틸아미노아세트알데히드에틸아세탈
영어명: 2,2-Diethoxy-N,N-dimethylethylamine
분자식: C8H19NO2
분자량: 161.24

이름 및 동의어

2,2-Diethoxy-N,N-dimethylethanamine(Dimethylamino)acetaldehyde diethyl acetal(2,2-Diethoxyethyl)dimethylamineEINECS 222-800-0SSFAUOAQOOISRQ-UHFFFAOYSA-DTXSID80189726EC 222-800-0NSC 62042RefChem:3943532.2DiethoxyN.NdimethylethylamineDTXCID40112217222-800-0

이름 더 보기

다이메틸아미노아세트알데하이드다이에틸아세탈디메틸아미노아세트알데히드에틸아세탈다이메틸아미노아세트알데하이드 다이에틸 아세탈2,2-디에톡시-N,N-디메틸에틸아민N-(2,2-DIETHOXYETHYL)DIMETHYLAMINE2,2-DIETHOXY-1-DIMETHYLAMINOETHANE2,2-Diethyoxy-N,N-dimethylethylamineEthanamine,2,2-diethoxy-N,N-dimethyl-

InChI=1/C8H19NO2/c1-5-10-8(11-6-2)7-9(3)4/h8H,5-7H2,1-4H33616-56-62,2-Diethoxy-N,N-dimethylethylamineDIMETHYLAMINOACETALDEHYDE DIETHYL ACETALEthanamine, 2,2-diethoxy-N,N-dimethyl-MFCD000092322,2-diethoxy-N,N-dimethylethan-1-aminedimethylaminoacetaldehyde diethylacetal

데이터베이스 식별자

CAS: 3616-56-6
PubChem CID: 77163
DTXSID: DTXSID80189726
UNII: E7NA7DR7QQ
EC Number: 222-800-0
Nikkaji: J97.891D

물성

구조 계산 물성

XLogP: 0.9
극성 표면적: 21.7 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 3
회전 가능 결합 수: 6
무거운 원자 수: 11
형식 전하: 0
복잡도: 80.2

실험 및 물리화학적 성질

Chemical ClassesNitrogen Compounds -> Other Nitrogen Compounds

Physical DescriptionClear yellow liquid; [Sigma-Aldrich MSDS]

물리화학적 성질

끓는 점: 170 °C · 170 °C (lit.)
밀도: 0.883 g/mL · 0.883 g/mL at 25 °C (lit.)
굴절률: 20 · n20/D 1.411(lit.)
인화점: 113 °F · 113 °F
저장 조건: 2 · under inert gas (nitrogen or Argon) at 2-8°C
물리적 상태: 투명한 액체
산도 계수 (pKa): 9.35 · 9.35±0.28(Predicted)
색상: 무색 내지 거의 무색
BRN: 1739149 · 1739149
InChI: InChI=1S/C8H19NO2/c1-5-10-8(11-6-2)7-9(3)4/h8H,5-7H2,1-4H3
InChIKey: SSFAUOAQOOISRQ-UHFFFAOYSA-N
SMILES: C(N(C)C)C(OCC)OCC
NIST: 2 · Ethanamine, 2,2-diethoxy-N,N-dimethyl-(3616-56-6)

화학적 성질

Colorless liquid

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H226 (98.1%): 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 52 reports by companies from 10 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.