(R)-Benzyl (5-oxotetrahydrofuran-3-yl)carbamate

HCID 697924CAS 118399-28-3

기본 정보

표준 SMILES
O=C1C[C@@H](NC(=O)OCc2ccccc2)CO1
InChIKey
BNIBNUOPVTZWRT-SNVBAGLBSA-N
분자식
C12H13NO4
평균 분자량
235.24 g/mol
단동위원소 질량
235.0844579

이름 및 식별자

우선 이름
(R)-Benzyl (5-oxotetrahydrofuran-3-yl)carbamate
IUPAC
benzyl N-[(3R)-5-oxooxolan-3-yl]carbamate
영어명
Benzyl (R)-5-oxotetrahydrofuran-3-ylcarbamate
분자식
C12H13NO4
분자량
235.24

이름 및 동의어

(R)-Benzyl (5-oxotetrahydrofuran-3-yl)carbamate(R)-Benzyl 5-oxotetrahydrofuran-3-ylcarbamateRefChem:407381821-246-2944-412-7118399-28-3Benzyl (R)-5-oxotetrahydrofuran-3-ylcarbamatebenzyl N-[(3R)-5-oxooxolan-3-yl]carbamate(R)-3-(Cbz-amino)-5-oxotetrahydrofuranMFCD09839299(R)-4-(Cbz-amino)-2-oxotetrahydrofuran3(R)-[(Carbobenzyloxy)amino]-gamma-butyrolactone
이름 더 보기
S,β(R)-βR)-Bedaquiline-Pinene-D2,13CR)-6-Bromo-αS)-rel-Bedaquiline-1-naphthalenyl-β-Ethyl-3-methoxy-α-phenyl-3-quinolineethanol-(Carbobenzoxyamino)-&gamma
3(R)-[(Carbobenzyloxy)amino]-?-butyrolactonebenzyl (r)-(5-oxotetrahydrofuran-3-yl)carbamateCarbamic acid, [(3R)-tetrahydro-5-oxo-3-furanyl]-, phenylmethyl esterBenzyl (R)-Tetrahydro-5-oxo-3-furanylcarbamate(R)-beta-(Carbobenzoxyamino)-gamma-butyrolactoneOprea1_012853SCHEMBL382338DTXSID90351331

데이터베이스 식별자

CAS
118399-28-3
PubChem CID
697924
DTXSID
DTXSID90351331
EC Number
821-246-2、944-412-7
Nikkaji
J2.885.913I

물성

구조 계산 물성

XLogP
1.1
극성 표면적
64.6 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
4
회전 가능 결합 수
4
무거운 원자 수
17

물리화학적 성질

녹는점
105 to · 105.0 to 109.0 °C
끓는 점
466.1 · 466.1±44.0 °C(Predicted)
밀도
1.27 · 1.27
저장 조건
2 · 2-8°C
용해도
클로로포름, 디클로로메탄, 에틸아세테이트, 메탄올에 용해됨
물리적 상태
고체

화학적 성질

Off-White Solid

안전 및 규제

GHS 분류

GHS Classification · 6건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P271, P280, 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.;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

유해성 정보

Hazard Classes and Categories · 2건

Skin Irrit. 2 (100%);Eye Irrit. 2 (100%);STOT SE 3 (100%)

Skin Irrit. 2 (100%);Eye Irrit. 2 (100%);STOT SE 3 (100%)

안전 데이터

HS 번호
29321900
hazard_code
Xi
safety_code
24/25
위험 등급
IRRITANT

화학 및 산업

응용 분야

용도3(R)-[(Carbobenzyloxy)amino]-γ-butyrolactone (cas# 118399-28-3) is a compound useful in organic synthesis.

공급사50 곳

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
上海凌富药物研究有限公司+86(21)5895 0110 19945755304 · [email protected]
上海美洛英特化学有限公司15821661757 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]

관련 반응

10건

연결된 노트

불러오는 중…