AG0098BD

1083181-23-0 | tert-Butyl 3-(aminomethyl)-3-fluoroazetidine-1-carboxylate

AG0098BD

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CAS Number	1083181-23-0
Catalog Number	AG0098BD(AGN-PC-0WCJC3)
Chemical Name	tert-Butyl 3-(aminomethyl)-3-fluoroazetidine-1-carboxylate
IUPAC Name	tert-butyl 3-(aminomethyl)-3-fluoroazetidine-1-carboxylate
InChI	InChI=1S/C9H17FN2O2/c1-8(2,3)14-7(13)12-5-9(10,4-11)6-12/h4-6,11H2,1-3H3
InChI Key	HRNGGAXXQINCHD-UHFFFAOYSA-N
MDL Number	MFCD11559005
Molecular Formula	C9H17FN2O2
Molecular Weight	204.2419
SMILES	O=C(N1CC(F)(CN)C1)OC(C)(C)C
Synonyms	1083181-23-0, tert-butyl 3-(aminomethyl)-3-fluoroazetidine-1-carboxylate, 3-(AMINOMETHYL)-3-FLUORO-1-BOC-AZETIDINE, 1-BOC-3-(AMINOMETHYL)-3-FLUOROAZETIDINE, SCHEMBL13779824, DTXSID70705353, 3-(AMinoMethyl)-3-fluoro-..., KS-000006ZO, MFCD11559005, ZINC40434484, AKOS005259629, 1-Boc-3-fluoroazetidine-3-methanamine, FCH1404788, PB23887, AK172233, AS-34461, BC681945, PC420034, AX8333164, ST1010029, CS-0038955, Q-4046, F2147-8317,

Complexity	232
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	204.127g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	204.245g/mol
Monoisotopic Mass	204.127g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	55.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.2

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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