카르밤산,(3-히드록시-2-메틸프로필)-,1,1-디메틸에틸에스테르(9Cl)

Tert-butyl (3-hydroxy-2-methylpropyl)carbamate

HCID 11424042

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 480451-99-8
표준 SMILES: CC(CO)CNC(=O)OC(C)(C)C
InChIKey: BDAXTHWMUZLOHK-UHFFFAOYSA-N
분자식: C9H19NO3
평균 분자량: 189.25 g/mol
단동위원소 질량: 189.13649347

이름 및 식별자

우선 이름: Tert-butyl (3-hydroxy-2-methylpropyl)carbamate
IUPAC: tert-butyl N-(3-hydroxy-2-methylpropyl)carbamate
현지명: 카르밤산,(3-히드록시-2-메틸프로필)-,1,1-디메틸에틸에스테르(9Cl)
영어명: Carbamic acid, (3-hydroxy-2-methylpropyl)-, 1,1-dimethylethyl ester (9CI)
분자식: C9H19NO3
분자량: 189.25

이름 및 동의어

480451-99-8tert-butyl (3-hydroxy-2-methylpropyl)carbamatetert-Butyl 3-hydroxy-2-methylpropylcarbamatetert-butyl N-(3-hydroxy-2-methylpropyl)carbamateCarbamic acid, (3-hydroxy-2-methylpropyl)-, 1,1-dimethylethyl ester (9CI)MFCD146357382-methyl-3-tert-butoxycarbonylaminopropanolSCHEMBL3163216DTXSID00465397BDAXTHWMUZLOHK-UHFFFAOYSA-NAB8715Carbamic acid, (3-hydroxy-2-methylpropyl)-, 1,1-dimethylethyl ester

이름 더 보기

카르밤산,(3-히드록시-2-메틸프로필)-,1,1-디메틸에틸에스테르(9Cl)Carbamic acid, N-(3-hydroxy-2-methylpropyl)-, 1,1-dimethylethyl ester

XH11683-(Boc-amino)-2-methyl-1-propanolAKOS014320662N-Boc-3-hydroxy-2-methyl-propanamineSB47597SB47680SB84175AS-44909

데이터베이스 식별자

CAS: 480451-99-8
PubChem CID: 11424042
DTXSID: DTXSID00465397
Nikkaji: J1.896.413I

물성

구조 계산 물성

XLogP: 1
극성 표면적: 58.6 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 3
회전 가능 결합 수: 5
무거운 원자 수: 13
형식 전하: 0
복잡도: 163

물리화학적 성질

저장 조건: 2 · 2-8°C
InChI: InChI=1S/C9H19NO3/c1-7(6-11)5-10-8(12)13-9(2,3)4/h7,11H,5-6H2,1-4H3,(H,10,12)
InChIKey: BDAXTHWMUZLOHK-UHFFFAOYSA-N
SMILES: C(OC(C)(C)C)(=O)NCC(C)CO