2,5-dioxopyrrolidin-1-yl 1-(2-chloroacetamido)-3,6,9,12-tetraoxapentadecan-15-oate

2,5-dioxopyrrolidin-1-yl 1-(2-chloroacetamido)-3,6,9,12-tetraoxapentadecan-15-oate

CAS: 1353011-95-6

Formula: C17H27ClN2O9

SMILES: ClCC(=O)NCCOCCOCCOCCOCCC(=O)ON1C(=O)CCC1=O

IUPAC: 2,5-dioxopyrrolidin-1-yl 1-(2-chloroacetamido)-3,6,9,12-tetraoxapentadecan-15-oate

InChI: InChI=1S/C17H27ClN2O9/c18-13-14(21)19-4-6-26-8-10-28-12-11-27-9-7-25-5-3-17(24)29-20-15(22)1-2-16(20)23/h1-13H2,(H,19,21)

Composition: C (46.53%), H (6.20%), Cl (8.08%), N (6.38%), O (32.81%)

Molar Mass: 438.86

Atom Count: 56

Heavy Atom Count: 29

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	438.1405082
Formal Charge	0
FSP3	0.76
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	8
Hydrogen Bond Donor Count	1
InChIKey	BPWFCYSNJLMFRO-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	99.63
Topological Polar Surface Area	129.7
Polarizability	39.56
Ring Count	1
Rotatable Bond Count	18

Suppliers

Axispharm

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<2 Days	1353011-95-6		$207.90-$784.35$207.90$519.75$784.35