(S)-Di(naphthalen-2-yl)(pyrrolidin-2-yl)methanol

HCID 2733810
노트반응
부분 구조 검색유사 구조 찾기

기본 정보

CAS
127986-84-9
표준 SMILES
OC(c1ccc2ccccc2c1)(c1ccc2ccccc2c1)[C@@H]1CCCN1
InChIKey
LNUDNNFEXRHHGY-DEOSSOPVSA-N
분자식
C25H23NO
평균 분자량
353.5 g/mol
단동위원소 질량
353.17796436

이름 및 식별자

우선 이름
(S)-Di(naphthalen-2-yl)(pyrrolidin-2-yl)methanol
IUPAC
dinaphthalen-2-yl-[(2S)-pyrrolidin-2-yl]methanol
영어명
(S)-(-)-alpha,alpha-Di(2-naphthyl)-2-pyrrolidinemethanol
분자식
C25H23NO
분자량
353.46

이름 및 동의어

127986-84-9(S)-Di(naphthalen-2-yl)(pyrrolidin-2-yl)methanoldinaphthalen-2-yl-[(2S)-pyrrolidin-2-yl]methanol(s)-(-)-alpha,alpha-di(2-naphthyl)-2-pyrrolidinemethanolbis(2-naphthyl)-[(2S)-pyrrolidin-2-yl]methanol2-Pyrrolidinemethanol, alpha,alpha-di-2-naphthalenyl-, (2S)-((2S)pyrrolidin-2-yl)di(2-naphthyl)methan-1-olC25H23NOMFCD00269672(S)-(-)-|A,|A-Di-(2-naphthyl)-2-pyrrolidine methanolDi(naphthalen-2-yl)[(2S)-pyrrolidin-2-yl]methanolSCHEMBL3849511
이름 더 보기
(S)-DI-2-NAPHTHYLPROLINOL(S)-DI-2-NAPHTHYLPROLINOL 99%(S)-Di-2-naphthylprolinol,99%S-α,α-Di-(2-naphthyl)-2-pyrrolidine methanol(S)-(-)-DI-(2-NAPHTHYL)-2-PYRROLIDINEMETHANOL(S)-dinaphthalen-2-yl(pyrrolidin-2-yl)methanol(S)-(-)-A,A-DI(2-NAPHTHYL)-2-PYRROLIDINEMETHANOL2-Pyrrolidinemethanol, α,α-di-2-naphthalenyl-, (2S)-
DTXSID90370007LNUDNNFEXRHHGY-DEOSSOPVSA-NSBB027335AKOS017345033AS-85516ST50405797(S)-dinaphthalen-2-ylpyrrolidin-2-ylmethanolG78142

데이터베이스 식별자

CAS
127986-84-9
PubChem CID
2733810
DTXSID
DTXSID90370007
EC Number
623-946-1
Nikkaji
J1.391.967D

물성

구조 계산 물성

XLogP
5.2
극성 표면적
32.3 Ų
수소 결합 공여자 수
2
수소 결합 수용자 수
2
회전 가능 결합 수
3
무거운 원자 수
27

물리화학적 성질

녹는점
135 · 135-138 °C(lit.)
끓는 점
486.87 °C · 486.87°C (rough estimate)
밀도
1.1008 · 1.1008 (rough estimate)
굴절률
1.6 · 1.6000 (estimate)
저장 조건
2 · 2-8°C(protect from light)
물리적 상태
powder

화학적 성질

white to light yellow crystal powde

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；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]；H413 (100%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]

P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, 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 39 reports by companies from 2 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 CategoriesAcute Tox. 4 (100%)；Skin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (100%)；Aquatic Chronic 4 (100%)

안전 데이터

wgk
3
risk_code
36/37/38-22
hazard_code
Xi,Xn
safety_code
26-36
Hazard Classifications
Acute Tox. 4 OralAquatic Chronic 4Eye Irrit. 2Skin Irrit. 2STOT SE 3
스토리지 클래스
11 - Combustible Solids

화학 및 산업

공급사22 곳

杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
重庆张邦医药科技有限责任公司028-84252981 18583719936 · [email protected]
天津狄克特科技有限公司22-58627059 13920586291 · [email protected]
宝鸡缔都医药化工有限公司029-81145305 17791533577 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]

관련 반응

1건
반응 기록 만들기

화합물 노트

불러오는 중…