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4-amino-N-(oxolan-2-ylmethyl)benzamide hydrochloride

4-amino-N-(oxolan-2-ylmethyl)benzamide hydrochloride

CAS: 1158242-72-8

Formula: C12H17ClN2O2

SMILES: Cl.NC1=CC=C(C=C1)C(=O)NCC1CCCO1

IUPAC: 4-amino-N-[(oxolan-2-yl)methyl]benzamide hydrochloride

InChI: InChI=1/C12H16N2O2.ClH/c13-10-5-3-9(4-6-10)12(15)14-8-11-2-1-7-16-11;/h3-6,11H,1-2,7-8,13H2,(H,14,15);1H

Composition: C (56.14%), H (6.67%), Cl (13.81%), N (10.91%), O (12.46%)

Molar Mass: 256.73

Atom Count: 34

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 256.0978555
Formal Charge 0
FSP3 0.42
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey DEVNYSFGIGCMEP-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 62.99
Topological Polar Surface Area 64.35
Polarizability 23.48
Ring Count 2
Rotatable Bond Count 3

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Purity LeadTime CAS PacketSize UnitPrice
95% <4 Days 1158242-72-8 $58.65-$232.30$58.65$232.30
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