AG00BXLR

3601-89-6 | 1-Chloro-3,5-di-O-toluoyl-2-deoxy-D-ribofuranose

AG00BXLR

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CAS Number	3601-89-6
Catalog Number	AG00BXLR(AGN-PC-0RBJ03)
Chemical Name	1-Chloro-3,5-di-O-toluoyl-2-deoxy-D-ribofuranose
EC Number	224-367-3
IUPAC Name	[(2R,3S)-5-chloro-3-(4-methylbenzoyl)oxyoxolan-2-yl]methyl 4-methylbenzoate
InChI	InChI=1S/C21H21ClO5/c1-13-3-7-15(8-4-13)20(23)25-12-18-17(11-19(22)26-18)27-21(24)16-9-5-14(2)6-10-16/h3-10,17-19H,11-12H2,1-2H3/t17-,18+,19?/m0/s1
InChI Key	FJHSYOMVMMNQJQ-PAMZHZACSA-N
MDL Number	MFCD00079148
Molecular Formula	C21H21ClO5
Molecular Weight	388.8414
SMILES	O=C(O[C@@H]1[C@@H](COC(C2=CC=C(C)C=C2)=O)OC(Cl)C1)C3=CC=C(C)C=C3
Synonyms	3601-89-6, (2R,3S)-5-chloro-2-(((4-methylbenzoyl)oxy)methyl)tetrahydrofuran-3-yl 4-methylbenzoate, 2-Deoxy-3,5-di-O-p-toluoyl-D-erythro-pentofuranosyl chloride, 1-Chloro-2-deoxy-3,5-di-O-toluoyl-D-ribofuranose, 1-Chloro-3,5-di-O-toluoyl-2-deoxy-D-ribofuranose, 4330-21-6, 3,5-Di-O-p-toluyl-2-deoxy-a-D-ribofuranosyl chloride, PubChem19393, PubChem19394, 2-Deoxy-3,5-di-O-p-toluoyl-D-ribofuranosyl Chloride, SCHEMBL119054, KS-00001DIV, CS-B0031, ANW-47231, AKOS015919626, BR-77097, DS-16976, TC-135976, S-6299, W-202495, 3-O,5-O-Di-p-toluoyl-2-deoxy-D-ribofuranosyl chloride, 2-Deoxy-3,5-di-O-p-toluoyl-D-erythro-pentofuranosylchloride, (2R,3S)-5-chloro-2-((4-methylbenzoyloxy)methyl)tetrahydrofuran-3-yl 4-methylbenzoate, (2R,3S)-5-chloro-2-[(4-methylbenzoyloxy)methyl]oxolan-3-yl 4-methylbenzoate, [(2R,3S)-5-chloro-3-(4-methylbenzoyl)oxyoxolan-2-yl]methyl 4-methylbenzoate, C21H21CLO5, C21-H21-Cl-O5, EINECS 224-367-3, ACN-049858, 1-Chloro-3,5-bis[O-(4-toluoyl)]-2-deoxyribose, 3,5-Di-O-p-toluoyl-2-deoxy-D-ribofuranosyl Chloride, 2-Deoxydi(p-toluoyl)-alpha-D-erythro-pentofuranosyl chloride, .alpha.-D-erythro-Pentofuranosyl chloride, 2-deoxy-, bis(4-methylbenzoate), D-erythro-Pentofuranosylchloride, 2-deoxy-, 3,5-bis(4-methylbenzoate),

Complexity	509
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Exact Mass	388.108g/mol
Formal Charge	0
Heavy Atom Count	27
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	388.844g/mol
Monoisotopic Mass	388.108g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	61.8A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	4.9

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

Lot Number