AG00A3DT

1363380-79-3 | 6-Aminomethyl-2-Boc-2-aza-spiro[3.3]heptane

AG00A3DT

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CAS Number	1363380-79-3
Catalog Number	AG00A3DT(AGN-PC-0WAIZU)
Chemical Name	6-Aminomethyl-2-Boc-2-aza-spiro[3.3]heptane
IUPAC Name	tert-butyl 6-(aminomethyl)-2-azaspiro[3.3]heptane-2-carboxylate
InChI	InChI=1S/C12H22N2O2/c1-11(2,3)16-10(15)14-7-12(8-14)4-9(5-12)6-13/h9H,4-8,13H2,1-3H3
InChI Key	XLVAGFMRBBLZLW-UHFFFAOYSA-N
MDL Number	MFCD22419342
Molecular Formula	C12H22N2O2
Molecular Weight	226.3153
SMILES	O=C(N1CC2(CC(CN)C2)C1)OC(C)(C)C
Synonyms	1363380-79-3, tert-butyl 6-(aminomethyl)-2-azaspiro[3.3]heptane-2-carboxylate, 6-AMINOMETHYL-2-BOC-2-AZA-SPIRO[3.3]HEPTANE, KS-000006WO, MFCD22419342, ZINC95743138, AKOS025290087, FCH1642491, PB36773, SB20097, AK172186, CS-0048174, 2-Boc-6-aminomethyl-2-azaspiro[3.3]heptane, Q-4617, tert-Butyl 2-(aminomethyl)-6-azaspiro[3.3]heptane-6-carboxylate,

Complexity	282
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	226.168g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	226.32g/mol
Monoisotopic Mass	226.168g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	55.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.8

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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