AG00038V

1009335-36-7 | 2-Pyrrolidinemethanol, 4-hydroxy-, hydrochloride (1:1), (2R,4R)-

AG00038V

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CAS Number	1009335-36-7
Catalog Number	AG00038V(AGN-PC-0WAFIK)
Chemical Name	2-Pyrrolidinemethanol, 4-hydroxy-, hydrochloride (1:1), (2R,4R)-
IUPAC Name	(3R,5R)-5-(hydroxymethyl)pyrrolidin-3-ol;hydrochloride
InChI	InChI=1S/C5H11NO2.ClH/c7-3-4-1-5(8)2-6-4;/h4-8H,1-3H2;1H/t4-,5-;/m1./s1
InChI Key	IUHDMWJWUWKOFE-TYSVMGFPSA-N
MDL Number	MFCD17676315
Molecular Formula	C5H12ClNO2
Molecular Weight	153.6073
SMILES	Cl.OC[C@H]1C[C@H](CN1)O
Synonyms	1009335-36-7, (3R,5R)-5-(hydroxymethyl)pyrrolidin-3-ol hydrochloride, IUHDMWJWUWKOFE-TYSVMGFPSA-N, SCHEMBL2567829, 2-Pyrrolidinemethanol, 4-hydroxy-, hydrochloride (1:1), (2R,4R)-, MFCD17676315, AKOS027446398, KS-0000009K, DS-19068, FT-0669849, (3R,5R)-5-(Hydroxymethyl)pyrrolidin-3-ol HCl, ACN-031258, (2R,4R)-4-Hydroxy-2-pyrrolidinemethanol Hydrochloride, 4-HYDROXY-(2R,4R)-2-PYRROLIDINEMETHANOLHYDROCHLORIDE,

Complexity	76.8
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Exact Mass	153.056g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	4
Isotope Atom Count	0
Molecular Weight	153.606g/mol
Monoisotopic Mass	153.056g/mol
Rotatable Bond Count	1
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
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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