Cedryl formate
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Cedryl formate
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CAS No:
39900-38-4
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Formula:
C16H26O2
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Chemical Name:
Cedryl formate
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Synonyms:
1H-3a,7-Methanoazulen-6-ol,octahydro-3,6,8,8-tetramethyl-,6-formate,(3R,3aS,6R,7R,8aS)-;1H-3a,7-Methanoazulen-6-ol,octahydro-3,6,8,8-tetramethyl-,formate,[3R-(3α,3aβ,6α,7β,8aα)]-;1H-3a,7-Methanoazulen-6-ol,octahydro-3,6,8,8-tetramethyl-,formate,(3R,3aS,6R,7R,8aS)-;Cedrol formate;Cedryl formate;2258643-19-3
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CAS No:
Characteristics
26.3
4.42640
1.03g/cm3
309.7ºC at 760 mmHg
126.8ºC
1.506
Oral-rat LD50: > 5000 mg/kg
Thermal decomposition spicy irritating smoke
Safety Information
The warehouse is low-temperature, ventilated and dry
P264, P280, P305+P351+P338, P33, P313
H319
|Warning|H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]|P264, P280, P305+P351+P338, and P337+P313|Aggregated GHS information provided by 113 companies from 2 notifications to the ECHA C&L Inventory.
Cedryl formate Use and Manufacturing
1H-3a,7-Methanoazulen-6-ol, octahydro-3,6,8,8-tetramethyl-, 6-formate, (3R,3aS,6R,7R,8aS)-: ACTIVE
Computed Properties
Molecular Weight:250.38
XLogP3:4.5
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:250.193280068
Monoisotopic Mass:250.193280068
Topological Polar Surface Area:26.3
Heavy Atom Count:18
Complexity:375
Defined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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