AG0013BJ

1374658-52-2 | 1-Boc-3-fluoroazetidine-3-carbaldehyde

AG0013BJ

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CAS Number	1374658-52-2
Catalog Number	AG0013BJ(AGN-PC-0WCKX3)
Chemical Name	1-Boc-3-fluoroazetidine-3-carbaldehyde
IUPAC Name	tert-butyl 3-fluoro-3-formylazetidine-1-carboxylate
InChI	InChI=1S/C9H14FNO3/c1-8(2,3)14-7(13)11-4-9(10,5-11)6-12/h6H,4-5H2,1-3H3
InChI Key	ISYAISBXCKGQPD-UHFFFAOYSA-N
MDL Number	MFCD23105995
Molecular Formula	C9H14FNO3
Molecular Weight	203.2108
SMILES	O=CC1(F)CN(C(OC(C)(C)C)=O)C1
Synonyms	1-Boc-3-fluoroazetidine-3-carbaldehyde, 1374658-52-2, tert-butyl 3-fluoro-3-formylazetidine-1-carboxylate, SCHEMBL20158236, ZINC95743224, AKOS025403565, FCH2311221, PB37400, SB20688, AK185027, CS-0079086, Q-4756,

Complexity	253
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	203.096g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	203.213g/mol
Monoisotopic Mass	203.096g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	46.6A^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-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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