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| CAS No.: | 13002-64-7 |
|---|---|
| Name: | N,N-bis(2-aminoethyl)-1,3-propanediamine |
| Article Data: | 3 |
| Cas Database | |
| Molecular Structure: | |
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| Formula: | C7H20N4 |
| Molecular Weight: | 160.263 |
| Synonyms: | Bis(2-aminoethyl)(3-aminopropyl)amine; |
| EINECS: | 225-254-1 |
| Density: | 0.987 g/cm3 |
| Boiling Point: | 259.616 °C at 760 mmHg |
| Flash Point: | 109.545 °C |
| PSA: | 81.30000 |
| LogP: | 0.65550 |
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- 173606-50-3BOC-10-AMINODECANOIC ACID
- 361456-36-2METHYL (R)-(+)-ISOCYANATO-3-PHENYLPROPI&
- 5156-58-1N-(1-Benzyl-4-pipperidinyl)-N-phenylpropanamide HCl
- 81281-59-67-Benzylideneaminotheophylline
- 50288-62-5threo-Phenyl-2-piperidyl acetamide
- 82993-81-5D-threo-Ritalinic acid hydrochloride
- 47087-37-6Z-D-Glu-OMe
- 73441-42-6METHYL-5-CHLORO-2,2-DIMETHYLVALERATE
- Total:3 Page 1 of 1 1
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Specification
The 1,3-Propanediamine,N1,N1-bis(2-aminoethyl)-, with the CAS registry number 13002-64-7, is also known as Bis(2-aminoethyl)(3-aminopropyl)amine. This chemical's molecular formula is C7H20N4 and molecular weight is 160.2605. What's more, its systematic name is N,N-Bis(2-aminoethyl)propane-1,3-diamine.
Physical properties about 1,3-Propanediamine,N1,N1-bis(2-aminoethyl)- are: (1)ACD/LogP: -2.07; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): -7; (4)ACD/LogD (pH 7.4): -7; (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): 1; (9)#H bond acceptors: 4; (10)#H bond donors: 6; (11)#Freely Rotating Bonds: 10; (12)Polar Surface Area: 81.3 Å2; (13)Index of Refraction: 1.513; (14)Molar Refractivity: 48.806 cm3; (15)Molar Volume: 162.368 cm3; (16)Polarizability: 19.348×10-24 cm3; (17)Surface Tension: 46.254 dyne/cm; (18)Density: 0.987 g/cm3; (19)Flash Point: 109.545 °C; (20)Enthalpy of Vaporization: 49.727 kJ/mol; (21)Boiling Point: 259.616 °C at 760 mmHg; (22)Vapour Pressure: 0.013 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: NCCN(CCCN)CCN
(2) InChI: InChI=1/C7H20N4/c8-2-1-5-11(6-3-9)7-4-10/h1-10H2
(3) InChIKey: VHCPBLNDTKVHTI-UHFFFAOYAA