CAS 136735-95-0 Methyl-duphos, (S,S)- (HCID 2734553)

기본 정보

CAS: 136735-95-0
표준 SMILES: C[C@H]1CC[C@H](C)P1c1ccccc1P1[C@@H](C)CC[C@@H]1C
InChIKey: AJNZWRKTWQLAJK-VGWMRTNUSA-N
분자식: C18H28P2
평균 분자량: 306.4 g/mol
단동위원소 질량: 306.16662416

이름 및 식별자

우선 이름: Methyl-duphos, (S,S)-
IUPAC: (2S,5S)-1-[2-[(2S,5S)-2,5-dimethylphospholan-1-yl]phenyl]-2,5-dimethylphospholane
현지명: (+)-1,2-BIS[(2S,5S)-2,5-디메틸포스폴라노]벤젠
영어명: (+)-1,2-Bis[(2S,5S)-2,5-dimethylphospholano]benzene
분자식: C18H28P2
분자량: 306.36

이름 및 동의어

136735-95-0(S,S)-Methyl-DUPHOS(S,S)-Me-DUPHOSMethyl-duphos, (S,S)-(S,S)-Me-duphos [MI](S,S)-Methyl-duphos, (+)-UNII-HL745J99SBHL745J99SBDTXSID90159910(S,S)-1,2-Bis(2,5-dimethylphospholano)benzenePhospholane, 1,1'-(1,2-phenylene)bis(2,5-dimethyl-, (2S,2'S,5S,5'S)-Phospholane, 1,1'-(1,2-phenylene)bis[2,5-dimethyl-, (2S,2'S,5S,5'S)-

이름 더 보기

(+)-1,2-BIS[(2S,5S)-2,5-디메틸포스폴라노]벤젠(+)-1,2-Bis((2S,5S)-2,5-dimethylphospholano)benzene1,2-Bis[(2S,5S)-2,5-dimethyl-1-phospholanyl]benzene1,2-Bis[(2S,5S)-2,5-diMethyl-1-phospholanyl]benzene, 97+%(+)-1,2-Bis[(2S,5S)-2,5-diMethylphospholano]benzene kanata purity

RefChem:158118DTXCID9082401(+)-1,2-Bis[(2S,5S)-2,5-dimethylphospholano]benzene1,2-Bis((2S,5S)-2,5-dimethylphospholan-1-yl)benzeneMFCD00142322(2S,5S)-1-[2-[(2S,5S)-2,5-dimethylphospholan-1-yl]phenyl]-2,5-dimethylphospholaneD83772C18H28P2

데이터베이스 식별자

물성

구조 계산 물성

XLogP: 3.8
극성 표면적: 0 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 0
회전 가능 결합 수: 2
무거운 원자 수: 20
형식 전하: 0
복잡도: 277

물리화학적 성질

녹는점: 67 · 67-76 °C
끓는 점: 415 · 415.0±15.0 °C(Predicted)
저장 조건: 2 · under inert gas (nitrogen or Argon) at 2-8°C
물리적 상태: 수정 같은
색상: 하얀색
수용성: 물에 불용성.
BRN: 4810602 · 4810602
InChI: InChI=1S/C18H28P2/c1-13-9-10-14(2)19(13)17-7-5-6-8-18(17)20-15(3)11-12-16(20)4/h5-8,13-16H,9-12H2,1-4H3/t13-,14-,15-,16-/m0/s1
InChIKey: AJNZWRKTWQLAJK-VGWMRTNUSA-N
SMILES: C1(P2[C@@H](C)CC[C@@H]2C)=CC=CC=C1P1[C@@H](C)CC[C@@H]1C

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P264, P270, P301+P317, P330, 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 CategoriesAcute Tox. 4 (100%)

안전 데이터

wgk: 3
risk_code: 36/37/38
hazard_code: Xi
safety_code: 26-36
F 고인화성물질: 1-10
스토리지 클래스: 11 - Combustible Solids

화학 및 산업

응용 분야

용도It is a DuPhos and BPE ligands which are highly efficient privileged ligands.

공급사53 곳

郑州阿尔法化工有限公司+86-18530059196 · [email protected]

毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]

上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]

天津瑞德法莫科技有限公司13821803402 · [email protected]

上海凌凯科技股份有限公司58950110 13124863828 · [email protected]

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