AG00HWP5

1428330-69-1 | tert-Butyl 3-(bromomethyl)-3-hydroxyazetidine-1-carboxylate

AG00HWP5

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CAS Number	1428330-69-1
Catalog Number	AG00HWP5(AGN-PC-0WNGX5)
Chemical Name	tert-Butyl 3-(bromomethyl)-3-hydroxyazetidine-1-carboxylate
IUPAC Name	tert-butyl 3-(bromomethyl)-3-hydroxyazetidine-1-carboxylate
InChI	InChI=1S/C9H16BrNO3/c1-8(2,3)14-7(12)11-5-9(13,4-10)6-11/h13H,4-6H2,1-3H3
InChI Key	HQQDJMWHMNPDOJ-UHFFFAOYSA-N
MDL Number	MFCD30489914
Molecular Formula	C9H16BrNO3
Molecular Weight	266.1322
SMILES	O=C(N1CC(O)(CBr)C1)OC(C)(C)C
Synonyms	tert-butyl 3-(bromomethyl)-3-hydroxyazetidine-1-carboxylate, 1428330-69-1, KS-000006DD, MFCD30489914, AKOS030630934, ZINC575441146, SB22264, AS-53622, 1-Boc-3-(bromomethyl)-3-hydroxyazetidine, CS-0048369, t-Butyl 3-(bromomethyl)-3-hydroxyazetidine-1-carboxylate,

Complexity	231
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	265.031g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	266.135g/mol
Monoisotopic Mass	265.031g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	49.8A^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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