기본 정보
- 표준 SMILES
CNCCNC(=O)OC(C)(C)C- InChIKey
GKWGBMHXVRSFRT-UHFFFAOYSA-N- 분자식
- C8H18N2O2
- 평균 분자량
- 174.24 g/mol
- 단동위원소 질량
- 174.13682782
이름 및 식별자
- 우선 이름
- N-(tert-Butoxycarbonyl)-N'-methylethylenediamine
- IUPAC
- tert-butyl N-[2-(methylamino)ethyl]carbamate
- 현지명
- tert-부틸2-(메틸아미노)에틸카바메이트
- 영어명
- tert-Butyl 2-(methylamino)ethylcarbamate
- 분자식
- C8H18N2O2
- 분자량
- 174.24
이름 및 동의어
N-(tert-Butoxycarbonyl)-N'-methylethylenediamineRefChem:828692805-762-5122734-32-1tert-Butyl 2-(methylamino)ethylcarbamatetert-Butyl (2-(methylamino)ethyl)carbamatetert-butyl N-[2-(methylamino)ethyl]carbamate1-(Boc-amino)-2-(methylamino)ethaneMFCD06808585N-Boc-2-methylamino-ethylamineN-Boc-N'-methylethylenediamineCarbamic acid, N-[2-(methylamino)ethyl]-, 1,1-dimethylethyl ester
이름 더 보기
tert-부틸2-(메틸아미노)에틸카바메이트BUTTPARK 90\06-211-BOC-AMINO-2-METHYLAMINO-ETHANEBoc-2-(Methylamino)ethylcarbamate2-N-Boc-N1-methylethane-1,2-diamineN-Boc-2-methylamino-ethylamine, 98%1-Boc-Amino-2-methylamino-ethane ,98%ert-Butyl2-(methylamino)ethylcarbamatetert-Butyl 2-(methylamino)ethylcarbamat
tert-butyl(2-(methylamino)ethyl)carbamatetert-butyl [2-(methylamino)ethyl]carbamateBoc-2-methylamino-ethylcarbamateTert-butyl (2-methylamino-ethyl)-carbamate(2-Methylamino-ethyl)-carbamic acid tert-butyl esterBocNHCH2CH2NHMeTert-butyl N-(2-methylaminoethyl)carbamateCarbamic acid, [2-(methylamino)ethyl]-, 1,1-dimethylethyl ester
데이터베이스 식별자
- CAS
122734-32-1- PubChem CID
- 3435744
- DTXSID
DTXSID70392464- EC Number
- 805-762-5
물성
구조 계산 물성
- XLogP
- 0.5
- 극성 표면적
- 50.4 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 3
- 회전 가능 결합 수
- 5
- 무거운 원자 수
- 12
- 형식 전하
- 0
- 복잡도
- 140
물리화학적 성질
- 녹는점
- 35 °C · 35 °C
- 끓는 점
- 260.1 · 260.1±23.0 °C(Predicted)
- 밀도
- 0.958 · 0.958±0.06 g/cm3(Predicted)
- 저장 조건
- Keep in dark place,Sealed in dry,Room Temperature
- 용해도
- 메탄올에 용해됨
- 물리적 상태
- powder to lump
- 산도 계수 (pKa)
- 12 · 12+-.0.46(Predicted)
- 색상
- 흰색에서 거의 흰색
- InChI
- InChI=1S/C8H18N2O2/c1-8(2,3)12-7(11)10-6-5-9-4/h9H,5-6H2,1-4H3,(H,10,11)
- InChIKey
- GKWGBMHXVRSFRT-UHFFFAOYSA-N
- SMILES
- C(OC(C)(C)C)(=O)NCCNC
화학적 성질
White to very pale yellow solid
안전 및 규제
GHS 분류
GHS Classification
Danger
H301 (25%): Toxic if swallowed [Danger Acute toxicity, oral]
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 4 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Hazard Classes and CategoriesAcute Tox. 3 (25%)
안전 데이터
- HS 번호
- 2921490090
- risk_code
- 25
- hazard_code
- T
- safety_code
- 45
화학 및 산업
상·하류 제품 정보
상류 원료
하류 제품
공급사50 곳
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
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上海蓝润化学有限公司021-69515658 ; 69515628 13701998368 · [email protected]
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兰州华浩生物医药科技有限责任公司18189674620 · [email protected]
Accela ChemBio Inc.+1(858) 699-3322 · [email protected]
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