Products Categories
| CAS No.: | 5843-65-2 |
|---|---|
| Name: | Demethyl-Coclaurine |
| Article Data: | 10 |
| Molecular Structure: | |
|
|
|
| Formula: | C16H17NO3 |
| Molecular Weight: | 271.316 |
| Synonyms: | 6,7-Isoquinolinediol,1,2,3,4-tetrahydro-1-[(4-hydroxyphenyl)methyl]-, (?à)-;Coclaurine, O-demethyl-, (?à)- (8CI);(RS)-Norcoclaurine;1-(4-hydroxybenzyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol;(±)-HIGENAMINE;1-(4-Hydroxybenzyl)-1,2,3,4-tetrahydro-6,7-isoquinolinediol;Higenamine;dl-Demethylcoclaurine;6,7-isoquinolinediol, 1,2,3,4-tetrahydro-1-[(4-hydroxyphenyl)methyl]-;6,7-Isoquinolinediol, 1,2,3,4-tetrahydro-1-((4-hydroxyphenyl)methyl)-, (±)-;Isoquinolin-6,7-diol, 1,2,3,4-tetrahydro-1-[4-hydroxybenzyl]-; |
| Density: | 1.317 g/cm3 |
| Melting Point: | 208-210 °C |
| Boiling Point: | 522.4 °C at 760 mmHg |
| Flash Point: | 209.6 °C |
| PSA: | 72.72000 |
| LogP: | 2.56170 |
- 81281-59-67-Benzylideneaminotheophylline
- 82993-81-5D-threo-Ritalinic acid hydrochloride
- 73441-42-6METHYL-5-CHLORO-2,2-DIMETHYLVALERATE
- 68439-39-4Poly(oxy-1,2-ethanediyl), alpha-(2-ethylhexyl)-omega-hydroxy-,
- 852475-26-4MC1568
- 958254-66-51H-Imidazo[4,5-b]pyridine-2-carboxaldehyde, 1-methyl-, hydrochloride
- 99170-93-1N-Methyl-2-oxazolamine
- 717878-06-31-(4-fluorophenyl)-4-nitro-1H-imidazole
- 914458-26-7[5-(2-fluorophenyl)-1-pentyl-1H-pyrrol-3-yl]-1-naphthalenyl-Methanone
- 894852-01-87-BROMO-2,2-DIMETHYL-2H-PYRIDO[3,2-B][1,4]OXAZIN-3(4H)-ONE
What can I do for you?
Get Best Price
Specification
The Isoquinolin-6,7-diol, 1,2,3,4-tetrahydro-1-[4-hydroxybenzyl]-, with the CAS registry number 800401-62-1, has the systematic name of 1-(4-hydroxybenzyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol. It belongs to the product categories of Anilines, Aromatic Amines and Nitro Compounds. And the molecular formula of this chemical is C16H17NO3.
The physical properties of Benzoic acid,4-(pentyloxy)- are as following: (1)ACD/LogP: 1.41; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.55; (4)ACD/LogD (pH 7.4): -0.24; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 3.12; (9)#H bond acceptors: 4; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 30.93 Å2; (13)Index of Refraction: 1.666; (14)Molar Refractivity: 76.58 cm3; (15)Molar Volume: 205.8 cm3; (16)Polarizability: 30.36×10-24cm3; (17)Surface Tension: 64 dyne/cm; (18)Density: 1.317 g/cm3; (19)Flash Point: 209.6 °C; (20)Enthalpy of Vaporization: 82.58 kJ/mol; (21)Boiling Point: 522.4 °C at 760 mmHg; (22)Vapour Pressure: 1.56E-11 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: CCOC(=O)c1cc-2[nH]c(ccc2n1)Cl
(2)InChI: InChI=1/C10H9ClN2O2/c1-2-15-10(14)8-5-7-6(12-8)3-4-9(11)13-7/h3-5,13H,2H2,1H3
(3)InChIKey: KJRHDQHGMZAGOS-UHFFFAOYAH