ethyl (2E)-3-(pyrrolidin-1-yl)prop-2-enoate

ethyl (2E)-3-(pyrrolidin-1-yl)prop-2-enoate

CAS: 65651-80-1

Formula: C9H15NO2

SMILES: CCOC(=O)C=CN1CCCC1

IUPAC: ethyl (2E)-3-(pyrrolidin-1-yl)prop-2-enoate

InChI: InChI=1S/C9H15NO2/c1-2-12-9(11)5-8-10-6-3-4-7-10/h5,8H,2-4,6-7H2,1H3/b8-5+

Composition: C (63.88%), H (8.93%), N (8.28%), O (18.91%)

Molar Mass: 169.224

Atom Count: 27

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	169.110278727
Formal Charge	0
FSP3	0.67
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	VFFHLZJSZHWXAJ-VMPITWQZSA-N
Lipinski's Rule of Five	1
Molar Refractivity	48.05
Topological Polar Surface Area	29.54
Polarizability	18.24
Ring Count	1
Rotatable Bond Count	4

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	65651-80-1		$121.06-$409.83$121.06$409.83