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| Name |
4-Hydroxybutyl-(3-hydroxypropyl)-N-nitrosamine |
EINECS | N/A |
| CAS No. | 62018-90-0 | Density | 1.15g/cm3 |
| PSA | 73.13000 | LogP | 0.12470 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C7H16N2O3 | Boiling Point | 394.3°C at 760 mmHg |
| Molecular Weight | 176.25 | Flash Point | 192.2°C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Mutation data reported. Many N-nitroso compounds are carcinogens. When heated to decomposition it emits toxic fumes of NOx. See also NITROSAMINES. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
4-(N-(3-Hydroxypropyl)-N-nitrosoamino)-1-butanol;N-(3-Hydroxypropyl)-N-(4-hydroxybutyl)nitrosamine;4-Hydroxybutyl-(3-hydroxypropyl)-N-nitrosamin;1-BUTANOL,4-(N-(3-HYDROXYPROPYL)-N-NITROSOAMINO);4-Hydroxybutyl-(3-hydroxypropyl)-N-nitrosamine; |
4-Hydroxybutyl-(3-hydroxypropyl)-N-nitrosamine Chemical Properties
Product Name: 4-Hydroxybutyl-(3-hydroxypropyl)-N-nitrosamine (CAS NO.62018-90-0)
Molecular Formula: C7H16N2O3
Molecular Weight: 176.25g/mol
Mol File: 62018-90-0.mol
Boiling point: 394.3 °C at 760 mmHg
Flash Point: 192.2 °C
Density: 1.15 g/cm3
Surface Tension: 45.1 dyne/cm
Enthalpy of Vaporization: 74.49 kJ/mol
Vapour Pressure: 7.52E-08 mmHg at 25°C
XLogP3-AA: -0.1
H-Bond Donor: 2
H-Bond Acceptor: 3
Structure Descriptors of 4-Hydroxybutyl-(3-hydroxypropyl)-N-nitrosamine (CAS NO.62018-90-0):
IUPAC Name: N-(4-hydroxybutyl)-N-(3-hydroxypropyl)nitrous amide
Canonical SMILES: C(CCO)CN(CCCO)N=O
InChI: InChI=1S/C7H16N2O3/c10-6-2-1-4-9(8-12)5-3-7-11/h10-11H,1-7H2
InChIKey: QCYLJPGUDLXUOE-UHFFFAOYSA-N
4-Hydroxybutyl-(3-hydroxypropyl)-N-nitrosamine Toxicity Data With Reference
| 1. | mmo-sat 1 mg/plate | MUREAV Mutation Research. 68 (1979),195. |
4-Hydroxybutyl-(3-hydroxypropyl)-N-nitrosamine Safety Profile
Mutation data reported. Many N-nitroso compounds are carcinogens. When heated to decomposition it emits toxic fumes of NOx. See also NITROSAMINES.
4-Hydroxybutyl-(3-hydroxypropyl)-N-nitrosamine Specification
4-Hydroxybutyl-(3-hydroxypropyl)-N-nitrosamine , its CAS NO. is 62018-90-0, the synonyms are 4-(N-(3-Hydroxypropyl)-N-nitrosoamino)-1-butanol ; BRN 2082848 ; N-(3-Hydroxypropyl)-N-(4-hydroxybutyl)nitrosamine ; 1-Butanol, 4-(N-(3-hydroxypropyl)-N-nitrosoamino)- .
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