AG008RU0

1104000-68-1 | (3R,4R)-PYRROLIDINE-3,4-DIOL

AG008RU0

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CAS Number	1104000-68-1
Catalog Number	AG008RU0(AGN-PC-0WAKA8)
Chemical Name	(3R,4R)-PYRROLIDINE-3,4-DIOL
IUPAC Name	(3R,4R)-pyrrolidine-3,4-diol;hydrochloride
InChI	InChI=1S/C4H9NO2.ClH/c6-3-1-5-2-4(3)7;/h3-7H,1-2H2;1H/t3-,4-;/m1./s1
InChI Key	VADWFRGDDJHKNB-VKKIDBQXSA-N
MDL Number	MFCD08686736
Molecular Formula	C4H10ClNO2
Molecular Weight	139.5807
SMILES	Cl.N1C[C@H]([C@@H](C1)O)O
Synonyms	(3R,4R)-Pyrrolidine-3,4-diol hydrochloride, 1104000-68-1, (3R,4R)-3,4-Pyrrolidinediol hydrochloride, 519188-72-8, SCHEMBL742834, VADWFRGDDJHKNB-VKKIDBQXSA-N, MFCD12405007, SB20486, SB20498, AK171626, DB-059993, (3R,4R)-pyrrolidine-3,4-diol monohydrochloride, trans-3,4-dihydroxypyrrolidine hydrochloride, trans-Pyrrolidine-3,4-diol hydrochloride, CIS-PYRROLIDINE-3,4-DIOL HYDROCHLORIDE, 186393-21-5,

Complexity	58.7
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Exact Mass	139.04g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	4
Isotope Atom Count	0
Molecular Weight	139.579g/mol
Monoisotopic Mass	139.04g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	52.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number