(+)-(2S,5R)-1-Allyl-2,5-dimethylpiperazine, (+)-Camphoric Acid Salt - CAS 186094-00-8

Catalog:	BB054889
Product Name:	(+)-(2S,5R)-1-Allyl-2,5-dimethylpiperazine, (+)-Camphoric Acid Salt
CAS:	186094-00-8
Synonyms:	(+)-(2S,5R)-1-Allyl-2,5-dimethylpiperazine, (+)-Camphoric Acid Salt; (2S,5R)-2,5-dimethyl-1-prop-2-enylpiperazine; (1R,3S)-1,2,2-trimethylcyclopentane-1,3-dicarboxylic acid; (1R,3S)-3-carboxy-1,2,2-trimethylcyclopentane-1-carboxylate; (2S,5R)-2,5-dimethyl-1-prop-2-enylpiperazin-4-ium

Technical Data

IUPAC Name:	(2S,5R)-2,5-dimethyl-1-prop-2-enylpiperazine(1R,3S)-1,2,2-trimethylcyclopentane-1,3-dicarboxylic acid
Description:	(+)-(2S,5R)-1-Allyl-2,5-dimethylpiperazine, (+)-Camphoric Acid Salt (cas# 186094-00-8) is a compound useful in organic synthesis.
Molecular Weight:	354.48
Molecular Formula:	C19H34N2O4
Canonical SMILES:	CC1CNC(CN1CC=C)C.CC1(C(CCC1(C)C(=O)O)C(=O)O)C
InChI:	InChI=1S/C10H16O4.C9H18N2/c1-9(2)6(7(11)12)4-5-10(9,3)8(13)141-4-5-11-7-8(2)10-6-9(11)3/h6H,4-5H2,1-3H3,(H,11,12)(H,13,14)4,8-10H,1,5-7H2,2-3H3/t6-,10+8-,9+/m11/s1
InChI Key:	GAUKCWXJAQLUCN-SLZMFKEQSA-N
Solubility:	Dimethyl Sulfoxide, Ethanol, Methanol
Appearance:	White Crystalline Solid

Complexity:	415
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	4
Defined Bond Stereocenter Count:	0
Exact Mass:	354.25185757
Formal Charge:	0
Heavy Atom Count:	25
Hydrogen Bond Acceptor Count:	6
Hydrogen Bond Donor Count:	3
Isotope Atom Count:	0
Monoisotopic Mass:	354.25185757
Rotatable Bond Count:	4
Topological Polar Surface Area:	89.9Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0