C2H20H2114124-pyritisyecklorile, 4 hal hidroky-2- (hidroksymil) -, 9R) - Achi)

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Pasipatan fisik

Sipat fisik konci	Nilai	Kaayaan
Beurat molekular	339.39	-
Titik ngagolak (diprediksi)	549.8 ± 40.0 ° C	Pencét: 760 Torr
Kapadetan (diprediksi)	1.318 ± 0,06 g / cm3	Temp: 20 ° C; Pencét: 760 Torr
Pair (diprediksi)	14.53 ± 0,40	TEMP anu paling asam: 25 ° C

Ngaran sareng identifikasi

Kanonical imut o = c (ed1c = 2c = cc = cc2c = 3c = cc = cc31) N4cc) Cc4co
Isomeerik cor
Atchi
Inchi = 1s / C2H21no4 / C22-11-13-9-14 (23) 100) 20) 20-12-180,78-18
H2 / t13-, 14 + / m0 / s1
Konci inci
Scxxcpgzgzgu-Uonogxrcs-n
3 ngaran séjén pikeun zat ieu
1-pyritisineckarkxylated, 4-hydrhobro-2- (hidroksymil) -, 9h flumyty-flumyny - flumetil); (ZCI); (ZCI); (ZCI); (ZKI); 9H-Fluoren-9-Ylmethl (2s, 4R) -4-wildroxy-2- (hidroksymil) -10 -14 -14 -1ylitis-pironinecarinecineculerilate (Aci); (3r, 5s) -n -n-3-hikkroakyfricidine-5-métanol

Diulalkeun sipat

Sipat sayogi

Biologis

Kimia

Perténaran

Lipinski

Struktur patali

Theresalia

Biologis

Harta	Nilai	Kaayaan	Sumber
Faktor bioconcation	49.6	pH 1; Temp: 25 ° C	(1) ACD
Faktor bioconcation	49.6	pH 2; Temp: 25 ° C	(1) ACD
Faktor bioconcation	49.6	pH 3; Temp: 25 ° C	(1) ACD
Faktor bioconcation	49.6	pH 4; Temp: 25 ° C	(1) ACD
Faktor bioconcation	49.6	pH 5; Temp: 25 ° C	(1) ACD
Faktor bioconcation	49.6	pH 6; Temp: 25 ° C	(1) ACD
Faktor bioconcation	49.6	pH 7; Temp: 25 ° C	(1) ACD
Faktor bioconcation	49.6	pH 8; Temp: 25 ° C	(1) ACD
Faktor bioconcation	49.6	pH 9; Temp: 25 ° C	(1) ACD
Faktor bioconcation	49.6	pH 10; Temp: 25 ° C	(1) ACD

(1) Diitung nganggo pangembangan kimia maju (ACD / Lab) Software v11.02 (© 199-202 Acd / LCS)

Kimia

Harta	Nilai	Kaayaan	Sumber
Kub	569	pH 1; Temp: 25 ° C	(1) ACD
Kub	569	pH 2; Temp: 25 ° C	(1) ACD
Kub	569	pH 3; Temp: 25 ° C	(1) ACD
Kub	569	pH 4; Temp: 25 ° C	(1) ACD
Kub	569	pH 5; Temp: 25 ° C	(1) ACD
Kub	569	pH 6; Temp: 25 ° C	(1) ACD
Kub	569	pH 7; Temp: 25 ° C	(1) ACD
Kub	569	pH 8; Temp: 25 ° C	(1) ACD
Kub	569	pH 9; Temp: 25 ° C	(1) ACD
Kub	569	pH 10; Temp: 25 ° C	(1) ACD

Harta	Nilai	Kaayaan	Sumber
log As	2.53	pH 1; Temp: 25 ° C	(1) ACD
log As	2.53	pH 2; Temp: 25 ° C	(1) ACD
log As	2.53	pH 3; Temp: 25 ° C	(1) ACD
log As	2.53	pH 4; Temp: 25 ° C	(1) ACD
log As	2.53	pH 5; Temp: 25 ° C	(1) ACD
log As	2.53	pH 6; Temp: 25 ° C	(1) ACD
log As	2.53	pH 7; Temp: 25 ° C	(1) ACD
log As	2.53	pH 8; Temp: 25 ° C	(1) ACD
log As	2.53	pH 9; Temp: 25 ° C	(1) ACD
log As	2.53	pH 10; Temp: 25 ° C	(1) ACD
logp	2.534 ± 0,636	Temp: 25 ° C	(1) ACD
Kebar intrinsik massic	0,078 g / l	Temp: 25 ° C	(1) ACD
Sahubat massa	0,078 g / l	pH 1; Temp: 25 ° C	(1) ACD
Sahubat massa	0,078 g / l	pH 2; Temp: 25 ° C	(1) ACD
Sahubat massa	0,078 g / l	pH 3; Temp: 25 ° C	(1) ACD
Sahubat massa	0,078 g / l	pH 4; Temp: 25 ° C	(1) ACD
Sahubat massa	0,078 g / l	pH 5; Temp: 25 ° C	(1) ACD
Sahubat massa	0,078 g / l	pH 6; Temp: 25 ° C	(1) ACD
Sahubat massa	0,078 g / l	pH 7; Temp: 25 ° C	(1) ACD
Sahubat massa	0,078 g / l	pH 8; Temp: 25 ° C	(1) ACD
Sahubat massa	0,078 g / l	pH 9; Temp: 25 ° C	(1) ACD
Sahubat massa	0,078 g / l	pH 10; Temp: 25 ° C	(1) ACD
Sahubat massa	0,078 g / l	Cai pH 7,00; Temp: 25 ° C	(1) ACD
Kebar intrinsik molar	2.3 x 10-4 mol / l	Temp: 25 ° C	(1) ACD
Kahirupan molar	2.3 x 10-4 mol / l	pH 1; Temp: 25 ° C	(1) ACD
Kahirupan molar	2.3 x 10-4 mol / l	pH 2; Temp: 25 ° C	(1) ACD
Kahirupan molar	2.3 x 10-4 mol / l	pH 3; Temp: 25 ° C	(1) ACD
Kahirupan molar	2.3 x 10-4 mol / l	pH 4; Temp: 25 ° C	(1) ACD
Kahirupan molar	2.3 x 10-4 mol / l	pH 5; Temp: 25 ° C	(1) ACD
Kahirupan molar	2.3 x 10-4 mol / l	pH 6; Temp: 25 ° C	(1) ACD
Kahirupan molar	2.3 x 10-4 mol / l	pH 7; Temp: 25 ° C	(1) ACD
Kahirupan molar	2.3 x 10-4 mol / l	pH 8; Temp: 25 ° C	(1) ACD

Harta	Nilai	Kaayaan	Sumber
Kahirupan molar	2.3 x 10-4 mol / l	pH 9; Temp: 25 ° C	(1) ACD
Kahirupan molar	2.3 x 10-4 mol / l	pH 10; Temp: 25 ° C	(1) ACD
Kahirupan molar	2.3 x 10-4 mol / l	Cai pH 7,00; Temp: 25 ° C	(1) ACD
Beurat molekular	339.39
Pka	14.53 ± 0,40	TEMP anu paling asam: 25 ° C	(1) ACD
Pka	-3.10 ± 0,60	Paling dasar temp: 25 ° C	(1) ACD
Tekenan uap	6.35 x 10-13 torr	Temp: 25 ° C	(1) ACD

(1) Diitung nganggo pangembangan kimia maju (ACD / Lab) Software v11.02 (© 199-202 Acd / LCS)

Perténaran

Harta	Nilai	Kaayaan	Sumber
Perténaran	1.318 ± 0,06 g / cm3	Temp: 20 ° C; Pencét: 760 Torr	(1) ACD
Masar	257.3 ± 3.0 cm3 / mol	Temp: 20 ° C; Pencét: 760 Torr	(1) ACD

(1) Diitung nganggo pangembangan kimia maju (ACD / Lab) Software v11.02 (© 199-202 Acd / LCS)

Lipinski

Harta	Nilai	Kaayaan	Sumber
Beungkeut bébas rotét	6		(1) ACD
H panarima	5		(1) ACD
H donor	2		(1) ACD
H donor / panarima	7		(1) ACD
logp	2.534 ± 0,636	Temp: 25 ° C	(1) ACD
Beurat molekular	339.39

Struktur patali

Harta	Nilai	Kaayaan	Sumber
Daérah permukaan polar	70.0 A2	(1) ACD

Theresalia

Harta	Nilai	Kaayaan	Sumber
Titik anu ngagolak	549.8 ± 40.0 ° C	Pencét: 760 Torr	(1) ACD
Enthalpy tina vaporisasi	87.32 ± 3.0 kj / mol	Pencét: 760 Torr	(1) ACD
Titik kaingetan	286.3 ± 27,3 ° C		(1) ACD