(2-아미노-2-메틸-프로필)-카르밤산TERT-부틸에스테르

tert-butyl N-(2-amino-2-methylpropyl)carbamate

HCID 17909918

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 95034-05-2
표준 SMILES: CC(C)(N)CNC(=O)OC(C)(C)C
InChIKey: KCBBEHBEAPOBSC-UHFFFAOYSA-N
분자식: C9H20N2O2
평균 분자량: 188.27 g/mol
단동위원소 질량: 188.15247788

이름 및 식별자

우선 이름: tert-butyl N-(2-amino-2-methylpropyl)carbamate
IUPAC: tert-butyl N-(2-amino-2-methylpropyl)carbamate
현지명: (2-아미노-2-메틸-프로필)-카르밤산TERT-부틸에스테르
영어명: (2-Amino-2-methyl-propyl)-carbamic acid tert-butyl ester
분자식: C9H20N2O2
분자량: 188.27

이름 및 동의어

tert-butyl N-(2-amino-2-methylpropyl)carbamateRefChem:895624825-651-595034-05-2tert-Butyl (2-amino-2-methylpropyl)carbamateMFCD11040212(2-AMINO-2-METHYL-PROPYL)-CARBAMIC ACID TERT-BUTYL ESTERtert-butyl N-(2-amino-2-methyl-propyl)carbamatetert-butyl 2-amino-2-methylpropylcarbamateN1-Boc-2-methyl-1,2-propanediaminet-butyl (2-amino-2-methyl-1-propyl)carbamateSCHEMBL854272

이름 더 보기

(2-아미노-2-메틸-프로필)-카르밤산TERT-부틸에스테르ert-butylN-(2-amino-2-methylpropyl)carbamate2-methyl-2-amino-tertbutyloxycarbonylpropylaminetert-butyl N-(2-amino-2-methyl-propyl)carbamate - [B88046]Carbamic acid, N-(2-amino-2-methylpropyl)-, 1,1-dimethylethyl ester

DTXSID60591565VDA03405Carbamic acid, (2-amino-2-methylpropyl)-, 1,1-dimethylethyl esterAKOS006283671SB40187BS-13868SY186730DB-080166

데이터베이스 식별자

CAS: 95034-05-2
PubChem CID: 17909918
DTXSID: DTXSID60591565
EC Number: 825-651-5
Nikkaji: J1.822.084I

물성

구조 계산 물성

XLogP: 0.6
극성 표면적: 64.4 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 3
회전 가능 결합 수: 4
무거운 원자 수: 13
형식 전하: 0
복잡도: 183

물리화학적 성질

끓는 점: 275.1 · 275.1±23.0 °C(Predicted)
밀도: 0.974 · 0.974±0.06 g/cm3(Predicted)
저장 조건: 2 · 2-8°C(protect from light)
산도 계수 (pKa): 13.42 · 13.42±0.46(Predicted)

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H303 (100%): May be harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, 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 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.