Ethyl 2-(4-hydroxypiperidin-1-yl)acetate - CAS 156380-44-8

Catalog:	BB065441
Product Name:	Ethyl 2-(4-hydroxypiperidin-1-yl)acetate
CAS:	156380-44-8
Synonyms:	ethyl 2-(4-hydroxypiperidin-1-yl)acetate; (4-Hydroxy-piperidin-1-yl)-acetic acid ethyl ester; ethyl2-(4-hydroxypiperidin-1-yl)acetate

Technical Data

Safety and Hazards

Computed Properties

IUPAC Name:	ethyl 2-(4-hydroxypiperidin-1-yl)acetate
Description:	Ethyl 2-(4-hydroxypiperidin-1-yl)acetate
Molecular Weight:	187.24
Molecular Formula:	C9H17NO3
Canonical SMILES:	CCOC(=O)CN1CCC(CC1)O
InChI:	InChI=1S/C9H17NO3/c1-2-13-9(12)7-10-5-3-8(11)4-6-10/h8,11H,2-7H2,1H3
InChI Key:	UDPXIIWXAUGKLP-UHFFFAOYSA-N

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Danger

Complexity:	164
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	187.1208434
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	187.1208434
Rotatable Bond Count:	4
Topological Polar Surface Area:	49.8Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.4