AG0022RQ

181258-46-8 | 1-Pyrrolidinecarboxylic acid, 2-(bromomethyl)-, 1,1-dimethylethyl ester

AG0022RQ

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CAS Number	181258-46-8
Catalog Number	AG0022RQ(AGN-PC-002NZZ)
Chemical Name	1-Pyrrolidinecarboxylic acid, 2-(bromomethyl)-, 1,1-dimethylethyl ester
IUPAC Name	tert-butyl 2-(bromomethyl)pyrrolidine-1-carboxylate
InChI	InChI=1S/C10H18BrNO2/c1-10(2,3)14-9(13)12-6-4-5-8(12)7-11/h8H,4-7H2,1-3H3
InChI Key	OSMADJAEHVCZKN-UHFFFAOYSA-N
MDL Number	MFCD03425263
Molecular Formula	C10H18BrNO2
Molecular Weight	264.1594
SMILES	CC(C)(C)OC(=O)N1CCCC1CBr
Synonyms	181258-46-8, tert-butyl 2-(bromomethyl)pyrrolidine-1-carboxylate, 2-Bromomethyl-pyrrolidine-1-carboxylic acid tert-butyl ester, tert-butyl2-(bromomethyl)pyrrolidine-1-carboxylate, 1-N-BOC-2-BROMOMETHYLPYRROLIDINE, 1-Boc-2-(bromomethyl)pyrrolidine, 1-Pyrrolidinecarboxylic acid, 2-(bromomethyl)-, 1,1-dimethylethyl ester, SCHEMBL398772, AC1Q1N48, CTK0E3008, DTXSID00564415, OSMADJAEHVCZKN-UHFFFAOYSA-N, 1-Boc-(2-Bromomethyl)pyrrolidine, HT959, ANW-55910, MFCD03425263, SBB075642, AKOS015836177, AB14642, RP29402, AK-53517, AM100406, DS-14138, SC-24848, AB1009688, DB-065357, ST2407639, TR-035971, 4CH-018852, A1892, CS-0085555, FT-0682236, Z3414, EN300-60183, Z-2481, tert-butyl 2-(bromomethyl)pyrrolidinecarboxylate, 2-Bromomethyl-pyrrolidine-1-carboxylic acid tert-b, J-505021, tert-butyl-2-(bromomethyl)pyrrolidine-1-carboxylate, I14-14364, (R)-tert-butyl2-(bromomethyl)pyrrolidine-1-carboxylate, Tert-butyl (2S)-2-(bromomethyl)pyrrolidine-1-carboxylate, (R)-tert-butyl 2-(bromomethyl)pyrrolidine-1-carboxylic acid, 181258-46-8 tert-butyl 2-(bromomethyl)pyrrolidine-1-carboxylate, tert-Butyl-3-(iodomethyl)piperidine-1-carboxylate; 1-Piperidinecarboxylic acid,3-(iodomethyl)-,1,1-dimethylethyl ester, C10H18BrNO2, (R)-tert-butyl 2-(bromomethyl)pyrrolidine-1-carboxylate, A4018, (S)-tert-butyl 2-(bromomethyl)pyrrolidine-1-carboxylate, 1039826-29-3, 128542-75-6,

Complexity	213
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	263.052g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	264.163g/mol
Monoisotopic Mass	263.052g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	29.5A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	2.4

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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