AG00ACVW

172843-97-9 | 4-N-Boc-AMino-4-carboxytetrahydropyran

AG00ACVW

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CAS Number	172843-97-9
Catalog Number	AG00ACVW(AGN-PC-0K2UIY)
Chemical Name	4-N-Boc-AMino-4-carboxytetrahydropyran
IUPAC Name	4-[(2-methylpropan-2-yl)oxycarbonylamino]oxane-4-carboxylic acid
InChI	InChI=1S/C11H19NO5/c1-10(2,3)17-9(15)12-11(8(13)14)4-6-16-7-5-11/h4-7H2,1-3H3,(H,12,15)(H,13,14)
InChI Key	SPPDKPRJPFTBEV-UHFFFAOYSA-N
MDL Number	MFCD02683136
Molecular Formula	C11H19NO5
Molecular Weight	245.2723
SMILES	CC(C)(C)OC(=O)NC1(CCOCC1)C(O)=O
Synonyms	172843-97-9, 4-N-BOC-AMINO-4-CARBOXYTETRAHYDROPYRAN, 4-(Boc-amino)tetrahydropyran-4-carboxylic acid, 4-((tert-Butoxycarbonyl)amino)tetrahydro-2H-pyran-4-carboxylic acid, MFCD02683136, 4-[(2-methylpropan-2-yl)oxycarbonylamino]oxane-4-carboxylic Acid, 4-{[(tert-butoxy)carbonyl]amino}oxane-4-carboxylic acid, 4-(TERT-BUTOXYCARBAMOYL)TETRAHYDROPYRAN-4-CARBOXYLIC ACID, 4-(tert-butoxycarbonylamino)tetrahydro-2H-pyran-4-carboxylic acid, 4-N-BOC-Amino-4-carboxytetrahydropyran, 95%, 4-[(tert-butoxycarbonyl)amino]tetrahydro-2H-pyran-4-carboxylic acid, 4-[(tert-butoxy)carbonylamino]-2H-3,4,5,6-tetrahydropyran-4-carboxylic acid, PubChem24383, AC1LOR3H, SCHEMBL289956, CTK0I3476, DTXSID50361471, SPPDKPRJPFTBEV-UHFFFAOYSA-N, KS-00000AJ4, ZINC1081430, 8903AA, SBB028575, AKOS012536369, CS-W008506, PB15717, RP28693, AJ-24958, AK-33677, AS-42013, SY014577, RT-009255, ST50307435, 4-(Boc-amino)tetrahydropyran-4-carboxylicAcid, MFCD02683136 (95%), J-515852, 4-[(tert-Butoxycarbonyl)amino]oxane-4-carboxylic acid, I14-20344, Z1200998567, 4-tert-Butoxycarbonylamino-tetrahydro-pyran-4-carboxylic acid, 2H-Pyran-4-carboxylicacid, 4-[[(1,1-dimethylethoxy)carbonyl]amino]tetrahydro-, 4-({[(1,1-Dimethylethyl)oxy]carbonyl}amino)tetrahydro-2H-pyran-4-carboxylic acid, C11H19NO5, CID1268219, 4-(N-tert-Butoxycarbonylamino)-4-carboxytetrahydropyran, 4-(tert-butoxycarbonyl)-tetrahydro-2H-pyran-4-carboxylic acid, 1384431-37-1, 17843-97-9,

Complexity	302
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	245.126g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	245.275g/mol
Monoisotopic Mass	245.126g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	84.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

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