C20H21NO4 Asid 1-pyrrolidinecarboxylic, 4-hydroxy-2- (hydroxymethyl)-, 9h- Fluoren-9-flmethyl ester, (2s, 4r)-(9ci, ACI) Delwedd yn cynnwys delwedd dan sylw

C20H21NO4 1-pyrrolidinecarboxylic asid, 4-hydroxy-2- (hydroxymethyl)-, 9h- fluoren-9 -ylmethyl ester, (2s, 4r)-(9ci, aci)

Gwybodaeth Sylfaenol:

Anfon E -bost atom

Manylion y Cynnyrch

Tagiau cynnyrch

Priodweddau Ffisegol

Priodweddau Ffisegol Allweddol	Gwerthfawrogom	Cyflyrasoch
Pwysau moleciwlaidd	339.39	-
Berwbwynt (a ragwelir)	549.8 ± 40.0 ° C.	Gwasg: 760 Torr
Dwysedd (a ragwelir)	1.318 ± 0.06 g/cm3	Temp: 20 ° C; Gwasg: 760 Torr
PKA (a ragwelir)	14.53 ± 0.40	Mwyaf Temp Asidig: 25 ° C.

Enwau a dynodwyr eraill

Gwên Canonaidd O = C (OCC1C = 2C = CC = CC2C = 3C = CC = CC31) N4CC (O) CC4CO
Gwên Isomerig C (OC (= O) N1 [C@H] (CO) C [C @@ H] (O) C1) C2C = 3C (C = 4C2 = CC = CC4) = CC = CC3
Inchi
Inchi = 1S/C20H21NO4/C22-11-13-9-14 (23) 10-21 (13) 20 (24) 25-12-19-17-7-7-3-1-5-15 (17) 16-6-2-4-8-18 (16) 19/H1-8,13-14,19,22-23h, 9-12, 9-12, 9-12
H2/T13-, 14+/M0/S1
Allwedd inchi
Scxxardqpgzaju-uonogxrcsa-n
3 enw arall ar gyfer y sylwedd hwn
Asid 1-pyrrolidinecarboxylic, 4-hydroxy-2- (hydroxymethyl)-, ester 9h-fluoren-9 -ylmethyl, (2s-trans)-(zci); 9h-fluoren-9 -ylmethyl (2s, 4r) -4-hydroxy-2- (hydroxymethyl) -1-pyrrolidinecarboxylate (ACI); (3R, 5S) -N-FMOC-3-hydroxypyrrolidine-5-methanol

Eiddo a ragwelir

Eiddo ar gael

Biolegol

Gemegol

Ddwysedd

Lipinski

Strwythur yn gysylltiedig

Thermol

Biolegol

Eiddo	Gwerthfawrogom	Cyflyrasoch	Ffynhonnell
Ffactor Bio -ganolbwynt	49.6	Ph 1; TEMP: 25 ° C.	(1) ACD
Ffactor Bio -ganolbwynt	49.6	Ph 2; TEMP: 25 ° C.	(1) ACD
Ffactor Bio -ganolbwynt	49.6	Ph 3; TEMP: 25 ° C.	(1) ACD
Ffactor Bio -ganolbwynt	49.6	Ph 4; TEMP: 25 ° C.	(1) ACD
Ffactor Bio -ganolbwynt	49.6	Ph 5; TEMP: 25 ° C.	(1) ACD
Ffactor Bio -ganolbwynt	49.6	Ph 6; TEMP: 25 ° C.	(1) ACD
Ffactor Bio -ganolbwynt	49.6	Ph 7; TEMP: 25 ° C.	(1) ACD
Ffactor Bio -ganolbwynt	49.6	Ph 8; TEMP: 25 ° C.	(1) ACD
Ffactor Bio -ganolbwynt	49.6	Ph 9; TEMP: 25 ° C.	(1) ACD
Ffactor Bio -ganolbwynt	49.6	Ph 10; TEMP: 25 ° C.	(1) ACD

Gemegol

Eiddo	Gwerthfawrogom	Cyflyrasoch	Ffynhonnell
Koc	569	Ph 1; TEMP: 25 ° C.	(1) ACD
Koc	569	Ph 2; TEMP: 25 ° C.	(1) ACD
Koc	569	Ph 3; TEMP: 25 ° C.	(1) ACD
Koc	569	Ph 4; TEMP: 25 ° C.	(1) ACD
Koc	569	Ph 5; TEMP: 25 ° C.	(1) ACD
Koc	569	Ph 6; TEMP: 25 ° C.	(1) ACD
Koc	569	Ph 7; TEMP: 25 ° C.	(1) ACD
Koc	569	Ph 8; TEMP: 25 ° C.	(1) ACD
Koc	569	Ph 9; TEMP: 25 ° C.	(1) ACD
Koc	569	Ph 10; TEMP: 25 ° C.	(1) ACD

Eiddo	Gwerthfawrogom	Cyflyrasoch	Ffynhonnell
log	2.53	Ph 1; TEMP: 25 ° C.	(1) ACD
log	2.53	Ph 2; TEMP: 25 ° C.	(1) ACD
log	2.53	Ph 3; TEMP: 25 ° C.	(1) ACD
log	2.53	Ph 4; TEMP: 25 ° C.	(1) ACD
log	2.53	Ph 5; TEMP: 25 ° C.	(1) ACD
log	2.53	Ph 6; TEMP: 25 ° C.	(1) ACD
log	2.53	Ph 7; TEMP: 25 ° C.	(1) ACD
log	2.53	Ph 8; TEMP: 25 ° C.	(1) ACD
log	2.53	Ph 9; TEMP: 25 ° C.	(1) ACD
log	2.53	Ph 10; TEMP: 25 ° C.	(1) ACD
logio	2.534 ± 0.636	TEMP: 25 ° C.	(1) ACD
Hydoddedd cynhenid torfol	0.078 g/l	TEMP: 25 ° C.	(1) ACD
Hydoddedd torfol	0.078 g/l	Ph 1; TEMP: 25 ° C.	(1) ACD
Hydoddedd torfol	0.078 g/l	Ph 2; TEMP: 25 ° C.	(1) ACD
Hydoddedd torfol	0.078 g/l	Ph 3; TEMP: 25 ° C.	(1) ACD
Hydoddedd torfol	0.078 g/l	Ph 4; TEMP: 25 ° C.	(1) ACD
Hydoddedd torfol	0.078 g/l	Ph 5; TEMP: 25 ° C.	(1) ACD
Hydoddedd torfol	0.078 g/l	Ph 6; TEMP: 25 ° C.	(1) ACD
Hydoddedd torfol	0.078 g/l	Ph 7; TEMP: 25 ° C.	(1) ACD
Hydoddedd torfol	0.078 g/l	Ph 8; TEMP: 25 ° C.	(1) ACD
Hydoddedd torfol	0.078 g/l	Ph 9; TEMP: 25 ° C.	(1) ACD
Hydoddedd torfol	0.078 g/l	Ph 10; TEMP: 25 ° C.	(1) ACD
Hydoddedd torfol	0.078 g/l	Dŵr heb ei drin pH 7.00; TEMP: 25 ° C.	(1) ACD
Hydoddedd cynhenid molar	2.3 x 10-4 mol/l	TEMP: 25 ° C.	(1) ACD
Hydoddedd molar	2.3 x 10-4 mol/l	Ph 1; TEMP: 25 ° C.	(1) ACD
Hydoddedd molar	2.3 x 10-4 mol/l	Ph 2; TEMP: 25 ° C.	(1) ACD
Hydoddedd molar	2.3 x 10-4 mol/l	Ph 3; TEMP: 25 ° C.	(1) ACD
Hydoddedd molar	2.3 x 10-4 mol/l	Ph 4; TEMP: 25 ° C.	(1) ACD
Hydoddedd molar	2.3 x 10-4 mol/l	Ph 5; TEMP: 25 ° C.	(1) ACD
Hydoddedd molar	2.3 x 10-4 mol/l	Ph 6; TEMP: 25 ° C.	(1) ACD
Hydoddedd molar	2.3 x 10-4 mol/l	Ph 7; TEMP: 25 ° C.	(1) ACD
Hydoddedd molar	2.3 x 10-4 mol/l	Ph 8; TEMP: 25 ° C.	(1) ACD

Eiddo	Gwerthfawrogom	Cyflyrasoch	Ffynhonnell
Hydoddedd molar	2.3 x 10-4 mol/l	Ph 9; TEMP: 25 ° C.	(1) ACD
Hydoddedd molar	2.3 x 10-4 mol/l	Ph 10; TEMP: 25 ° C.	(1) ACD
Hydoddedd molar	2.3 x 10-4 mol/l	Dŵr heb ei drin pH 7.00; TEMP: 25 ° C.	(1) ACD
Pwysau moleciwlaidd	339.39
PKA	14.53 ± 0.40	Mwyaf Temp Asidig: 25 ° C.	(1) ACD
PKA	-3.10 ± 0.60	Temp mwyaf sylfaenol: 25 ° C.	(1) ACD
Pwysau anwedd	6.35 x 10-13 Torr	TEMP: 25 ° C.	(1) ACD

Ddwysedd

Eiddo	Gwerthfawrogom	Cyflyrasoch	Ffynhonnell
Ddwysedd	1.318 ± 0.06 g/cm3	Temp: 20 ° C; Gwasg: 760 Torr	(1) ACD
Cyfaint molar	257.3 ± 3.0 cm3/mol	Temp: 20 ° C; Gwasg: 760 Torr	(1) ACD

Lipinski

Eiddo	Gwerthfawrogom	Cyflyrasoch	Ffynhonnell
Bondiau rotatable yn rhydd	6		(1) ACD
H Derbynyddion	5		(1) ACD
H rhoddwyr	2		(1) ACD
H rhoddwr/derbynnydd swm	7		(1) ACD
logio	2.534 ± 0.636	TEMP: 25 ° C.	(1) ACD
Pwysau moleciwlaidd	339.39

Strwythur yn gysylltiedig

Eiddo	Gwerthfawrogom	Cyflyrasoch	Ffynhonnell
Arwynebedd pegynol	70.0 a2	(1) ACD

Thermol

Eiddo	Gwerthfawrogom	Cyflyrasoch	Ffynhonnell
Berwbwyntiau	549.8 ± 40.0 ° C.	Gwasg: 760 Torr	(1) ACD
Enthalpi anweddiad	87.32 ± 3.0 kJ/mol	Gwasg: 760 Torr	(1) ACD
Phwynt fflach	286.3 ± 27.3 ° C.		(1) ACD