(S) -alpha-Propynylproline HCl

CAT: 0024-sc-472097Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0024-sc-472097Size:100 mg

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CAS Number

1217828-88-0

Chemical Information

(S)-2-(Prop-2-yn-1-yl)pyrrolidine-2-carboxylic acid hydrochloride

CAS Number	1217828-88-0
PubChem CID	45026928
IUPAC Name	(2S)-2-prop-2-ynylpyrrolidine-2-carboxylic acid;hydrochloride
Molecular Formula	C8H12ClNO2
Molecular Weight	189.64
Topological Polar Surface Area	49.3
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Heavy Atom Count	12
Formal Charge	0
Complexity	215

SMILES

C#CC[C@@]1(CCCN1)C(=O)O.Cl

InChI

InChI=1S/C8H11NO2.ClH/c1-2-4-8(7(10)11)5-3-6-9-8;/h1,9H,3-6H2,(H,10,11);1H/t8-;/m1./s1

InChIKey

HUPSJXIFWSWGFS-DDWIOCJRSA-N

Chemical Structure

2D Structure

CAS: 1217828-88-0

CID: 45026928

Formula: C8H12ClNO2

MW: 189.64

Interactive 3D Structure

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Computed Properties

Property	Value
Molecular Weight	189.64
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	189.0556563
Monoisotopic Mass	189.0556563
Topological Polar Surface Area	49.3 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	215
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	2
Compound Is Canonicalized	Yes

Catalog	Name
sc-470836	Boc- (S) -alpha-propynylproline
sc-296363	(S) -alpha-Benzylproline HCl
sc-296363A	(S) -alpha-Benzylproline HCl
sc-296359A	(S) -alpha- (3-Chlorobenzyl) proline HCl
sc-471086	(S) -alpha- (2-Cyanobenzyl) proline HCl
sc-296362A	(S) -alpha- (4-Methylbenzyl) proline HCl
sc-296360	(S) -alpha- (4-Bromobenzyl) proline HCl
sc-296358A	(S) -alpha- (2-Naphthalenylmethyl) proline HCl
sc-296358	(S) -alpha- (2-Naphthalenylmethyl) proline HCl
sc-296355A	(S) -alpha- (1-Naphthalenylmethyl) proline HCl

Catalog	Name
241879-01	S-a-Propynylproline·HCl
235808-01	Boc- (S) -a-propynylproline
287903-01	(R) -a-Propynylproline·HCl
235726-01	Boc- (R) -a-propynylproline
241606-01	(R) -a-Propynylproline·HCl 98+% (HPLC)
X749416	m-Xylene-alpha,alpha,alpha,alpha',alpha',alpha'-d6
TRC-X749406-10MG	o-Xylene-alpha,alpha,alpha,alpha',alpha',alpha'-d6
TRC-T793525-250ML	Alpha,Alpha,Alpha-Trifluorotoluene
F4100-03P	Fetoprotein, Alpha (alpha Fetoprotein, Alpha, alpha-Fetoprotein, Alpha, alpha-1-Fetoprotein, Alpha, Afp, alpha-Fetoglobulin)
T33399-01	M-Isophthalotoluidide, alpha, alpha, alpha, alpha', alpha', alpha'-hexafluoro-4-hydroxy-