AG00ELPS

609781-33-1 | tert-Butyl 4-(4-carbamoylphenoxy)piperidine-1-carboxylate

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CAS Number	609781-33-1
Catalog Number	AG00ELPS(AGN-PC-0SYAUW)
Chemical Name	tert-Butyl 4-(4-carbamoylphenoxy)piperidine-1-carboxylate
IUPAC Name	tert-butyl 4-(4-carbamoylphenoxy)piperidine-1-carboxylate
InChI	InChI=1S/C17H24N2O4/c1-17(2,3)23-16(21)19-10-8-14(9-11-19)22-13-6-4-12(5-7-13)15(18)20/h4-7,14H,8-11H2,1-3H3,(H2,18,20)
InChI Key	PMEPMWIIELZLHZ-UHFFFAOYSA-N
MDL Number	MFCD24470001
Molecular Formula	C17H24N2O4
Molecular Weight	320.3835
SMILES	O=C(N1CCC(OC2=CC=C(C(N)=O)C=C2)CC1)OC(C)(C)C
Synonyms	tert-Butyl 4-(4-carbamoylphenoxy)piperidine-1-carboxylate, 609781-33-1, AK143627, PMEPMWIIELZLHZ-UHFFFAOYSA-N, SCHEMBL5530954, DTXSID30630192, MFCD24470001, ZINC95670862, AKOS022176170, DS-3061, AJ-133504, AX8282871, 4CH-016623, tert-Butyl 4-(4-carbamoylphenoxy)-piperidine-1-carboxylate, tert-butyl 4-[4-(aminocarbonyl)phenoxy]-piperidine-1-carboxylate, 4-(4-Carbamoyl-phenoxy)-piperidine-1-carboxylic acid tert-butyl ester,

Complexity	417
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	320.174g/mol
Formal Charge	0
Heavy Atom Count	23
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	320.389g/mol
Monoisotopic Mass	320.174g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	81.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number