8-Boc-1,8-디아자스피로[4.5]…

tert-Butyl 1,8-diazaspiro(4.5)decane-8-carboxylate

HCID 25212666
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기본 정보

CAS
937729-06-1
표준 SMILES
CC(C)(C)OC(=O)N1CCC2(CCCN2)CC1
InChIKey
UZPDXRXHTUSGLN-UHFFFAOYSA-N
분자식
C13H24N2O2
평균 분자량
240.34 g/mol
단동위원소 질량
240.18377801

이름 및 식별자

우선 이름
tert-Butyl 1,8-diazaspiro(4.5)decane-8-carboxylate
IUPAC
tert-butyl 1,8-diazaspiro[4.5]decane-8-carboxylate
현지명
8-Boc-1,8-디아자스피로[4.5]…
영어명
1,8-Diazaspiro[4.5]decane-8-carboxylic acid, 1,1-dimethylethyl ester
분자식
C13H24N2O2
분자량
240.34

이름 및 동의어

937729-06-1tert-butyl 1,8-diazaspiro[4.5]decane-8-carboxylateDTXSID20649117tert-Butyl 1,8-diazaspiro(4.5)decane-8-carboxylateRefChem:383096DTXCID40599867829-411-08-Boc-1,8-Diaza-spiro[4.5]decane1,8-Diazaspiro[4.5]decane-8-carboxylic acid tert-butyl ester8-Boc-1,8-diazaspiro[4.5]decaneMFCD115011871,8-DIAZASPIRO[4.5]DECANE-8-CARBOXYLIC ACID,1,1-DIMETHYLETHYL ESTER
이름 더 보기
8-Boc-1,8-디아자스피로[4.5]…8-Boc-1,8-diazaspiro[4.5]...8-boc-1,8-diazospolar [4.5] decane1,8-Diazaspiro[4.5]decane-8-carboxylic acidtert-Butyl 1,8-diazaspiro[4.5]decane-8-carboxylate 95+%1,1-Dimethylethyl 1,8-diazaspiro[4.5]decane-8-carboxylatetert-Butyl 1,8-diazaspiro[4.5]decane-8-carboxylate oxalate1,8-Diazaspiro[4.5]decane-8-carboxylic acid,1,1-diMethylethy...
1,8-Diaza-spiro[4.5]decane-8-carboxylic acid tert-butyl esterSCHEMBL15777202UZPDXRXHTUSGLN-UHFFFAOYSA-N1,8-Diazaspiro[4.5]decane-8-carboxylic acid, 1,1-dimethylethyl esterAKOS015950402CS-W009183DS-7678PB22500

데이터베이스 식별자

CAS
937729-06-1
PubChem CID
25212666
DTXSID
DTXSID20649117
EC Number
829-411-0
Nikkaji
J2.689.096I

물성

구조 계산 물성

XLogP
1.5
극성 표면적
41.6 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
3
회전 가능 결합 수
2
무거운 원자 수
17

물리화학적 성질

끓는 점
337 · 337.0±35.0 °C(Predicted)
밀도
1.07 · 1.07±0.1 g/cm3(Predicted)
저장 조건
2 · under inert gas (nitrogen or Argon) at 2–8 °C
산도 계수 (pKa)
10.74 · 10.74±0.20(Predicted)
InChI
InChI=1S/C13H24N2O2/c1-12(2,3)17-11(16)15-9-6-13(7-10-15)5-4-8-14-13/h14H,4-10H2,1-3H3
InChIKey
UZPDXRXHTUSGLN-UHFFFAOYSA-N

안전 및 규제

GHS 분류

GHS Classification · 5건

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)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

유해성 정보

Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (100%)

안전 데이터

HS 번호
2933998090

화학 및 산업

응용 분야 · 1건

용도1,8-Diazaspiro[4.5]decane is a spiro bicyclic diamine compound recognized as a primarily structural component 1,8-Diazaspiro[4.5]decane-8-carboxylic acid, 1,1-dimethylethyl ester. This spirocyclic derivative often serves as a key intermediate in medicinal chemistry.

상·하류 제품 정보

공급사85 곳

南京优氟医药科技有限公司025-86755008 17751752005 · [email protected]
合肥翰刚医药科技有限公司+8618062405514 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
Aladdin Scientific[email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]

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