AG003A8A

916891-97-9 | tert-Butyl imidazolidine-1-carboxylate

AG003A8A

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CAS Number	916891-97-9
Catalog Number	AG003A8A(AGN-PC-0BT1GF)
Chemical Name	tert-Butyl imidazolidine-1-carboxylate
IUPAC Name	tert-butyl imidazolidine-1-carboxylate
InChI	InChI=1S/C8H16N2O2/c1-8(2,3)12-7(11)10-5-4-9-6-10/h9H,4-6H2,1-3H3
InChI Key	UROHOOQSDVUQGF-UHFFFAOYSA-N
MDL Number	MFCD22199572
Molecular Formula	C8H16N2O2
Molecular Weight	172.2248
SMILES	N1(CNCC1)C(=O)OC(C)(C)C
Synonyms	tert-Butyl imidazolidine-1-carboxylate, 916891-97-9, 1-Imidazolidinecarboxylic acid, 1,1-dimethylethyl ester, SCHEMBL1748631, DTXSID90726282, 5463AC, MFCD22199572, ZINC85221731, AKOS016006160, AK-94763, AS-50358, AJ-127111, C8H16N2O2, tert-Butylimidazolidine-1-carboxylate,

Complexity	174
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	172.121g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	172.228g/mol
Monoisotopic Mass	172.121g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	41.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.6

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

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