C11H16N6O4 Adenosine, 2-amino-2′ -O-methyl- (9CI, ACI)

Alaye ipilẹ:

Alaye ọja

ọja Tags

Awọn alaye nkan elo

Nọmba iforukọsilẹ CAS

80791-87-3

Key Properties Properties	Iye	Ipo
Òṣuwọn Molikula	296.28	-
Oju Iyọ (Ayẹwo)	121-122 °C	Ohun elo: kẹmika
Oju Ise (Asọtẹlẹ)	733,2 ± 70,0 °C	Tẹ: 760 Torr
iwuwo (Asọtẹlẹ)	1,98 ± 0,1 g / cm3	Iwọn otutu: 20 °C;Tẹ: 760 Torr
pKa (Asọtẹlẹ)	13.12 ± 0,70	Pupọ Epo otutu: 25 °C

Miiran awọn orukọ ati idamo

Ẹ̀RẸ̀ KẸ̀LẸ̀

OCC1OC(N2C= NC=3C(= NC(= NC32)N)N)C(OC)C1O

ISOMERIC SMILES

O(C)[C@H]1[C@H](N2C=3C(N=C2)=C(N)N=C(N)N3)O[C@H](CO)[C@H ]1O

InChi

InChi = 1S/C11H16N6O4/c1-20-7-6(19)4(2-18)21-10(7)17-3-14-5-8(12)15-11(13)16-9( 5)17/h3-4,6-7,10,18-19H,2H2,1H3,(H4,12,13,15,16) /t4-,6-,7-,10-/m1/s1

InChi Key

JLWUWXCKSOIFPS-KQYNXXCUSA-N

2 Awọn orukọ miiran fun nkan yii

2-Amino-2′-O-methyladenosine (ACI);2′-O-Methyl-2,6-diaminopurine riboside
Awọn ohun-ini ti o wa
Gbona

Gbona

Ohun ini	Iye	Ipo	Orisun
Ojuami Iyo	121-122 °C	Ohun elo: kẹmika	(1) CAS

(1) Kore, Anilkumar R.;Nucleosides, Nucleotides & Nucleic Acids, (2006), 25(3), 307-314, CAplus

Sipekitira esiperimenta

Spectra wa
UV ati Wiwa

Awọn ohun-ini asọtẹlẹ

Awọn ohun-ini ti o wa
Ti ibi
Kemikali
iwuwo
Lipinski
Ilana Jẹmọ
Gbona

Ti ibi

Ohun ini	Iye	Ipo	Orisun
Bioconcentration ifosiwewe	1.0	pH 1;Iwọn otutu: 25 °C	(1) ACD
Bioconcentration ifosiwewe	1.0	pH 2;Iwọn otutu: 25 °C	(1) ACD
Bioconcentration ifosiwewe	1.0	pH 3;Iwọn otutu: 25 °C	(1) ACD
Bioconcentration ifosiwewe	1.0	pH 4;Iwọn otutu: 25 °C	(1) ACD
Bioconcentration ifosiwewe	1.0	pH 5;Iwọn otutu: 25 °C	(1) ACD
Bioconcentration ifosiwewe	1.0	pH 6;Iwọn otutu: 25 °C	(1) ACD
Bioconcentration ifosiwewe	1.0	pH 7;Iwọn otutu: 25 °C	(1) ACD
Bioconcentration ifosiwewe	1.0	pH 8;Iwọn otutu: 25 °C	(1) ACD
Bioconcentration ifosiwewe	1.0	pH 9;Iwọn otutu: 25 °C	(1) ACD
Bioconcentration ifosiwewe	1.0	pH 10;Iwọn otutu: 25 °C	(1) ACD

Ohun ini Iye Ipò Orisun

Koc 1.0 pH 1;Iwọn otutu: 25 °C (1) ACD

Koc 1.0 pH 2;Iwọn otutu: 25 °C (1) ACD

Koc 1.0 pH 3;Iwọn otutu: 25 °C (1) ACD

Koc 1,21 pH 4;Iwọn otutu: 25 °C (1) ACD

Koc 6.90 pH 5;Iwọn otutu: 25 °C (1) ACD

Koc 13.5 pH 6;Iwọn otutu: 25 °C (1) ACD

Koc 14,9 pH 7;Iwọn otutu: 25 °C (1) ACD

Koc 15.1 pH 8;Iwọn otutu: 25 °C (1) ACD

Koc 15.1 pH 9;Iwọn otutu: 25 °C (1) ACD

Koc 15.1 pH 10;Iwọn otutu: 25 °C (1) ACD

logD -2.85 pH 1;Iwọn otutu: 25 °C (1) ACD

logD -2.76 pH 2;Iwọn otutu: 25 °C (1) ACD

logD -2.31 pH 3;Iwọn otutu: 25 °C (1) ACD

logD -1,46 pH 4;Iwọn otutu: 25 °C (1) ACD

logD -0.70 pH 5;Iwọn otutu: 25 °C (1) ACD

logD -0,41 pH 6;Iwọn otutu: 25 °C (1) ACD

logD -0,37 pH 7;Iwọn otutu: 25 °C (1) ACD

logD -0.36 pH 8;Iwọn otutu: 25 °C (1) ACD

logD -0.36 pH 9;Iwọn otutu: 25 °C (1) ACD

logD -0.36 pH 10;Iwọn otutu: 25 °C (1) ACD

logP -0.363 ± 0.611 Temp: 25 °C (1) ACD

Solubility Inu Ti Opo pupọ 1.6 g/L Iwọn otutu: 25 °C (1) ACD

Ibi Solubility 504 g/L pH 1;Iwọn otutu: 25 °C (1) ACD

Ibi Solubility 409 g/L pH 2;Iwọn otutu: 25 °C (1) ACD

Ibi Solubility 140 g/L pH 3;Iwọn otutu: 25 °C (1) ACD

Ibi Solubility 20 g / L pH 4;Iwọn otutu: 25 °C (1) ACD

Ibi Solubility 3.6 g / L pH 5;Iwọn otutu: 25 °C (1) ACD

Ibi Solubility 1.8 g / L pH 6;Iwọn otutu: 25 °C (1) ACD

Ibi Solubility 1.7 g / L pH 7;Iwọn otutu: 25 °C (1) ACD

Ibi Solubility 1.6 g / L pH 8;Iwọn otutu: 25 °C (1) ACD

Ibi Solubility 1.6 g/L pH 9;Iwọn otutu: 25 °C (1) ACD

Ibi Solubility 1.6 g / L pH 10;Iwọn otutu: 25 °C (1) ACD

iwuwo

Ohun ini	Iye	Ipo	Orisun
iwuwo	1,98 ± 0,1 g / cm3	Iwọn otutu: 20 °C;Tẹ: 760 Torr	(1) ACD
Iwọn didun Molar	149,3 ± 7,0 cm3 / mol	Iwọn otutu: 20 °C;Tẹ: 760 Torr	(1) ACD

Lipinski

Ohun ini	Iye	Ipo	Orisun
Larọwọto Rotatable Bonds	5		(1) ACD
H Awọn olugba	10		(1) ACD
H Awọn oluranlọwọ	6		(1) ACD
H Oluranlọwọ / Olugba Apapọ	16		(1) ACD
logP	-0.363 ± 0.611	Iwọn otutu: 25 °C	(1) ACD
Òṣuwọn Molikula	296.28