2,5-dioxopyrrolidin-1-yl 6-[(2,4-dinitrophenyl)amino]hexanoate

2,5-dioxopyrrolidin-1-yl 6-[(2,4-dinitrophenyl)amino]hexanoate

CAS: 82321-04-8

Formula: C16H18N4O8

SMILES: [O-][N+](=O)C1=CC=C(NCCCCCC(=O)ON2C(=O)CCC2=O)C(=C1)[N+]([O-])=O

IUPAC: 2,5-dioxopyrrolidin-1-yl 6-[(2,4-dinitrophenyl)amino]hexanoate

InChI: InChI=1S/C16H18N4O8/c21-14-7-8-15(22)18(14)28-16(23)4-2-1-3-9-17-12-6-5-11(19(24)25)10-13(12)20(26)27/h5-6,10,17H,1-4,7-9H2

Composition: C (48.73%), H (4.60%), N (14.21%), O (32.46%)

Molar Mass: 394.34

Atom Count: 46

Heavy Atom Count: 28

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	394.112463556
Formal Charge	0
FSP3	0.44
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	8
Hydrogen Bond Donor Count	1
InChIKey	IYBNUJCDIAGXNX-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	94.19
Topological Polar Surface Area	161.99
Polarizability	35.26
Ring Count	2
Rotatable Bond Count	11

Suppliers

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
98.48%	<7 Days	82321-04-8		$28.05-$84.15$28.05$51.43$84.15

Molecule Market Select

Purity	LeadTime	CAS		UnitPrice
98%	<14 Days	82321-04-8		Quote Only

AA BLOCKS INC

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<6 Days	82321-04-8		$424.35-$2,915.25$424.35$654.35$1,254.65$1,894.05$2,915.25

Molecule Market Select

Purity	LeadTime	CAS		UnitPrice
98%	<10 Days	82321-04-8		Quote Only

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<7 Days	82321-04-8		$178.02-$320.85$178.02$320.85

Molnova Chemicals

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<4 Days	82321-04-8		$71.09-$415.83$71.09$103.19$153.64$276.71$415.83