(3S,4S)-3-(carboxymethyl)-4-(prop-1-en-2-yl)pyrrolidine-2-carboxylic acid

(3S,4S)-3-(carboxymethyl)-4-(prop-1-en-2-yl)pyrrolidine-2-carboxylic acid

CAS: 487-79-6

Formula: C10H15NO4

SMILES: CC(=C)[C@H]1CNC([C@H]1CC(O)=O)C(O)=O

IUPAC: (3S,4S)-3-(carboxymethyl)-4-(prop-1-en-2-yl)pyrrolidine-2-carboxylic acid

InChI: InChI=1S/C10H15NO4/c1-5(2)7-4-11-9(10(14)15)6(7)3-8(12)13/h6-7,9,11H,1,3-4H2,2H3,(H,12,13)(H,14,15)/t6-,7+,9?/m0/s1

Composition: C (56.33%), H (7.09%), N (6.57%), O (30.01%)

Molar Mass: 213.233

Atom Count: 30

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	3
Exact Mass	213.100107967
Formal Charge	0
FSP3	0.6
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	3
InChIKey	VLSMHEGGTFMBBZ-PMDVUHRTSA-N
Lipinski's Rule of Five	1
Molar Refractivity	52.2
Topological Polar Surface Area	86.63
Polarizability	20.81
Ring Count	1
Rotatable Bond Count	4

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Purity	LeadTime	CAS	PacketSize	UnitPrice
99%	<5 Days	487-79-6		$142.49-$1,475.37$142.49$240.85$317.77$609.06$940.71$1,475.37