CHEMBRDG-BB 7957101
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CHEMBRDG-BB 7957101
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CAS No:
696616-81-6
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Formula:
C13H18N2O2
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Chemical Name:
CHEMBRDG-BB 7957101
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Synonyms:
methyl 3-amino-4-(1-piperidyl)benzoate;MLS000676051;SMR000296148;ZINC01060071;CHEMBRDG-BB 7957101;methyl 3-amino-4-piperidin-1-ylbenzoate;benzoic acid, 3-amino-4-(1-piperidinyl)-, methyl ester;3-amino-4-(1-piperidyl)benzoic acid methyl ester
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CAS No:
Safety Information
IRRITANT
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:234.29
XLogP3:2.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:234.136827821
Monoisotopic Mass:234.136827821
Topological Polar Surface Area:55.6
Heavy Atom Count:17
Complexity:264
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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