Products Categories
| CAS No.: | 5840-00-6 |
|---|---|
| Name: | 3,7-Diazabicyclo[3.3.0]octane |
| Molecular Structure: | |
|
|
|
| Formula: | C6H12N2 |
| Molecular Weight: | 112.175 |
| Synonyms: | 3,7-Diazabicyclo[3.3.0]octane;Octahydropyrrolo[3,4-r]pyrrole; |
| Density: | 0.975 g/cm3 |
| Boiling Point: | 193.822 °C at 760 mmHg |
| Flash Point: | 90.185 °C |
| PSA: | 24.06000 |
| LogP: | 0.08280 |
- 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
- Total:38 Page 1 of 1 1
What can I do for you?
Get Best Price
Specification
The systematic name of 3,7-Diazabicyclo[3.3.0]octane is octahydropyrrolo[3,4-c]pyrrole. With the CAS registry number 5840-00-6, it is also named as Pyrrolo[3,4-c]pyrrole,octahydro-. In addition, its molecular formula is C6H12N2 and its molecular weight is 112.17.
The other characteristics of 3,7-Diazabicyclo[3.3.0]octane can be summarized as: (1)ACD/LogP: 0.16; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)H bond acceptors: 2; (8)H bond donors: 2; (9)Freely Rotating Bonds: 0; (10)Polar Surface Area: 24.06 Å2; (11)Index of Refraction: 1.476; (12)Molar Refractivity: 32.419 cm3; (13)Molar Volume: 115.017 cm3; (14)Polarizability: 12.852×10-24cm3; (15)Surface Tension: 32.494 dyne/cm; (16)Density: 0.975 g/cm3; (17)Flash Point: 90.185 °C; (18)Enthalpy of Vaporization: 43.002 kJ/mol; (19)Boiling Point: 193.822 °C at 760 mmHg; (20)Vapour Pressure: 0.456 mmHg at 25 °C.
People can use the following data to convert to the molecule structure.
(1)SMILES:C1NCC2CNCC12
(2)InChI:InChI=1/C6H12N2/c1-5-2-8-4-6(5)3-7-1/h5-8H,1-4H2
(3)InChIKey:QFCMBRXRVQRSSF-UHFFFAOYAF
(4)Std. InChI:InChI=1S/C6H12N2/c1-5-2-8-4-6(5)3-7-1/h5-8H,1-4H2
(5)Std. InChIKey:QFCMBRXRVQRSSF-UHFFFAOYSA-N