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| Name |
AI 3-35770 |
EINECS | N/A |
| CAS No. | 52736-62-6 | Density | 0.975g/cm3 |
| PSA | N/A | LogP | N/A |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C14H25NO | Boiling Point | 355°Cat760mmHg |
| Molecular Weight | 223.3544 | Flash Point | 146°C |
| Transport Information | N/A | Appearance | N/A |
| Safety | A severe skin and eye irritant. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
N/A |
AI 3-35770 Chemical Properties
Product Name: AI 3-35770 (CAS NO.52736-62-6)
Molecular Formula: C14H25NO
Molecular Weight: 223.3544g/mol
Mol File: 52736-62-6.mol
Boiling point: 355 °C at 760 mmHg
Flash Point: 146 °C
Density: 0.975 g/cm3
Surface Tension: 35.5 dyne/cm
Enthalpy of Vaporization: 60.01 kJ/mol
Vapour Pressure: 3.22E-05 mmHg at 25°C
XLogP3-AA: 3.4
H-Bond Donor: 0
H-Bond Acceptor: 1
Structure Descriptors of AI 3-35770 (CAS NO.52736-62-6):
IUPAC Name: azepan-1-yl-(2-methylcyclohexyl)methanone
Canonical SMILES: CC1CCCCC1C(=O)N2CCCCCC2
InChI: InChI=1S/C14H25NO/c1-12-8-4-5-9-13(12)14(16)15-10-6-2-3-7-11-15/h12-13H,2-11H2,1H3
InChIKey: CJLSOGGQZIXSMO-UHFFFAOYSA-N
AI 3-35770 Toxicity Data With Reference
| 1. | skn-rbt 500 mg/24H SEV | NTIS** National Technical Information Service. (Springfield, VA 22161) (Formerly U.S. Clearinghouse for Scientific and Technical Information) AD-A144-424 . |
AI 3-35770 Safety Profile
A severe skin and eye irritant.
AI 3-35770 Specification
AI 3-35770 , its CAS NO. is 52736-62-6, the synonyms are ENT 35770 ; Hexahydro-1-((2-methylcyclohexyl)carbonyl)-1H-azepine ; NSC 195038 ; 1H-Azepine, hexahydro-1-((2-methylcyclohexyl)carbonyl)- .
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