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ethyl[2-(5-methoxy-1H-1,3-benzodiazol-2-yl)ethyl]amine

ethyl[2-(5-methoxy-1H-1,3-benzodiazol-2-yl)ethyl]amine

CAS: 915924-04-8

Formula: C12H17N3O

SMILES: CCNCCC1=NC2=CC(OC)=CC=C2N1

IUPAC: ethyl[2-(5-methoxy-1H-1,3-benzodiazol-2-yl)ethyl]amine

InChI: InChI=1S/C12H17N3O/c1-3-13-7-6-12-14-10-5-4-9(16-2)8-11(10)15-12/h4-5,8,13H,3,6-7H2,1-2H3,(H,14,15)

Composition: C (65.73%), H (7.81%), N (19.16%), O (7.30%)

Molar Mass: 219.288

Atom Count: 33

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 219.137162179
Formal Charge 0
FSP3 0.42
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey OINNSAWMDNQJFP-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 63.45
Topological Polar Surface Area 49.94
Polarizability 25.99
Ring Count 2
Rotatable Bond Count 5

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Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 915924-04-8 $269.51$269.51
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