(3R)-2-(((9H-fluoren-9-yl)methoxy)carbonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid

HCID 978342

Grundinformationen

CAS
130309-33-0
Standard-SMILES
O=C(O)[C@H]1Cc2ccccc2CN1C(=O)OCC1c2ccccc2-c2ccccc21
InChIKey
LIRBCUNCXDZOOU-HSZRJFAPSA-N
Summenformel
C25H21NO4
Durchschnittliche Molmasse
399,4 g/mol
Monoisotopische Masse
399,14705815

Namen und Bezeichner

Bevorzugter Name
(3R)-2-(((9H-fluoren-9-yl)methoxy)carbonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid
IUPAC
(3R)-2-(9H-fluoren-9-ylmethoxycarbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid
Englischer Name
N-Fmoc-D-1,2,3,4-Tetrahydroisoquinoline-3-carboxylic acid
Summenformel
C25H21NO4
Molmasse
399.44

Namen und Synonyme

(3R)-2-{[(9H-fluoren-9-yl)methoxy]carbonyl}-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid(3R)-2-(((9H-fluoren-9-yl)methoxy)carbonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid(3R)-2-[[(9H-Fluoren-9-yl)methoxy]carbonyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acidRefChem:400768811-735-9Fmoc-D-Tic-OH130309-33-0Fmoc-D-TicMFCD00144345(R)-2-(((9H-Fluoren-9-yl)methoxy)carbonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acidFmoc-D-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid(3R)-2-(9H-fluoren-9-ylmethoxycarbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid
Weitere Namen anzeigen
FMOC-D-TIQRARECHEM BK PT 0081N-ALPHA-(9-FLUORENYLMETHOXYCAFmoc-D-Tetrahydroisoquinoline-3-COON-Fmoc-D-1,2,3,4-Tetrahydroisoquinoline(9H-Fluoren-9-yl)MethOxy]Carbonyl D-Tic-OHFMOC-D-TETRAHYDROISOQUINOLINE-1-CARBOXYLIC ACID
n-fmoc-d-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid(R)-(-)-2-(9-Fluorenylmethoxycarbonyl)-1,2,3,4-Tetrahydro-3-Isoquinolinecarboxylic Acidfmoc-(3r)-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid2,3(1H)-Isoquinolinedicarboxylic acid, 3,4-dihydro-, 2-(9H-fluoren-9-ylmethyl) ester, (3R)-LIRBCUNCXDZOOU-HSZRJFAPSA-NFA95P6EJC7SCHEMBL13252698SCHEMBL29400546

Datenbank-Bezeichner

CAS
130309-33-0
PubChem CID
978342
UNII
FA95P6EJC7
EC Number
811-735-9

Eigenschaften

Berechnete Struktureigenschaften

XLogP
4,4
Polarare Oberfläche (TPSA)
66,8 Ų
H-Brücken-Donoren
1
H-Brücken-Akzeptoren
4
Frei drehbare Bindungen
4
Schwere Atome
30

Physikochemische Eigenschaften

Schmelzpunkt
160 · 160-164 °C
Siedepunkt
522.37 °C · 522.37°C (rough estimate)
Dichte
1.239 · 1.2390 (rough estimate)
Brechungsindex
1.6 · 1.6000 (estimate)
storage temp.
-20 °C · Sealed in dry,Store in freezer, under -20°C
Löslichkeit
Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc.

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 6 Einträge

This chemical does not meet GHS hazard criteria for 50% (1 of 2) of reports.

Warning

H315 (50%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (50%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (50%): 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 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Reported as not meeting GHS hazard criteria per 1 of 2 reports by companies.;There is 1 notification provided by 1 of 2 reports by companies with hazard statement code(s).;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.

Gefahrenhinweise

Hazard Classes and CategoriesSkin Irrit. 2 (50%);Eye Irrit. 2A (50%);STOT SE 3 (50%)

Sicherheitsdaten

wgk
3
hs_code
29334900
hazard_code
Xi
safety_code
24/25
hazard_class
IRRITANT
Speicherklasse
11 - Combustible Solids

Chemie und Industrie

Anwendungen

VerwendenFmoc-D-Tic-OH, is an amino acid derivative used in peptide chemistry.

Anbieter100 Anbieter

北京华美互利生物化工010-56205725 · [email protected]
郑州阿尔法化工有限公司+86-18530059196 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
江苏吉泰肽业科技有限公司051580855088 18762539991 · [email protected]
上海凌富药物研究有限公司+86(21)5895 0110 19945755304 · [email protected]

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