rel-(1R,3S)-3-[[(Phenylmethoxy)carbonyl]amino]cyclohexanecarboxylic acid
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![rel-(1R,3S)-3-[[(Phenylmethoxy)carbonyl]amino]cyclohexanecarboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/7bd9d89d96a34cb6a3273f710bd18ea1.png "rel-(1R,3S)-3-[[(Phenylmethoxy)carbonyl]amino]cyclohexanecarboxylic acid")
rel-(1R,3S)-3-[[(Phenylmethoxy)carbonyl]amino]cyclohexanecarboxylic acid
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CAS No:
952616-39-6
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Formula:
C15H19NO4
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Chemical Name:
rel-(1R,3S)-3-[[(Phenylmethoxy)carbonyl]amino]cyclohexanecarboxylic acid
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Synonyms:
Cyclohexanecarboxylic acid,3-[[(phenylmethoxy)carbonyl]amino]-,(1R,3S)-rel-;rel-(1R,3S)-3-[[(Phenylmethoxy)carbonyl]amino]cyclohexanecarboxylic acid;cis-3-(((Benzyloxy)carbonyl)amino)cyclohexanecarboxylic acid
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CAS No:
rel-(1R,3S)-3-[[(Phenylmethoxy)carbonyl]amino]cyclohexanecarboxylic acid Basic Attributes
277.31566
277.32
DTXSID40635077
Characteristics
79.12000
2.47
1.2±0.1 g/cm3
113-114 °C
484.7±44.0 °C at 760 mmHg
246.9±28.4 °C
1.565
Safety Information
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, and P362|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:277.31
XLogP3:2.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:277.13140809
Monoisotopic Mass:277.13140809
Topological Polar Surface Area:75.6
Heavy Atom Count:20
Complexity:339
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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rel-(1R,3S)-3-[[(Phenylmethoxy)carbonyl]amino]cyclohexanecarboxylic acid
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