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N-ethyl-3-(heptylamino)propanamide

N-ethyl-3-(heptylamino)propanamide

CAS: 1040690-33-2

Formula: C12H26N2O

SMILES: CCCCCCCNCCC(=O)NCC

IUPAC: N-ethyl-3-(heptylamino)propanamide

InChI: InChI=1S/C12H26N2O/c1-3-5-6-7-8-10-13-11-9-12(15)14-4-2/h13H,3-11H2,1-2H3,(H,14,15)

Composition: C (67.24%), H (12.23%), N (13.07%), O (7.46%)

Molar Mass: 214.353

Atom Count: 41

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 214.204513465
Formal Charge 0
FSP3 0.92
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey QFIGVBPBCKAYSQ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 64.62
Topological Polar Surface Area 41.13
Polarizability 25.57
Ring Count 0
Rotatable Bond Count 10

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Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 1040690-33-2 $212.83$212.83
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