AG00C7TF

336182-11-7 | L-beta-Homohydroxyproline hydrochloride

AG00C7TF

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CAS Number	336182-11-7
Catalog Number	AG00C7TF(AGN-PC-0O91YS)
Chemical Name	L-beta-Homohydroxyproline hydrochloride
IUPAC Name	2-[(2S,4R)-4-hydroxypyrrolidin-2-yl]acetic acid;hydrochloride
InChI	InChI=1S/C6H11NO3.ClH/c8-5-1-4(7-3-5)2-6(9)10;/h4-5,7-8H,1-3H2,(H,9,10);1H/t4-,5+;/m0./s1
InChI Key	YSPVOIKBQGMRKO-UYXJWNHNSA-N
MDL Number	MFCD01862867
Molecular Formula	C6H12ClNO3
Molecular Weight	181.6174
SMILES	O=C(O)C[C@H]1NC[C@H](O)C1.[H]Cl
Synonyms	2-((2S,4R)-4-Hydroxypyrrolidin-2-yl)acetic acid hydrochloride, L-beta-Homohydroxyproline hydrochloride, l-beta-hydroxyproline-hcl, 336182-11-7, 2-[(2S,4R)-4-hydroxypyrrolidin-2-yl]acetic acid hydrochloride, CS-WAA0246, YSPVOIKBQGMRKO-UYXJWNHNSA-N, 3939AB, L-|A-Homohydroxyproline hydrochloride, AKOS016010584, AS-48802, AX8244621, J-019274, (2S,4R)-4-Hydroxy-2-pyrrolidinylacetic acid hydrochloride, L-beta-Homohydroxyproline hydrochloride, >=98.0% (TLC), 2-[(2S,4R)-4-hydroxy-2-pyrrolidinyl]acetic acid;hydrochloride, 2-[(2S,4R)-4-hydroxypyrrolidin-2-yl]acetic acid;hydrochloride, 2-[(2S,4R)-4-oxidanylpyrrolidin-2-yl]ethanoic acid;hydrochloride, C6H12ClNO3,

Complexity	137
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Exact Mass	181.051g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	4
Isotope Atom Count	0
Molecular Weight	181.616g/mol
Monoisotopic Mass	181.051g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	69.6A^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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