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amino[4-(2-methylpropoxy)phenyl]methyl acetate

amino[4-(2-methylpropoxy)phenyl]methyl acetate

CAS: 955997-89-4

Formula: C13H19NO3

SMILES: CC(C)COC1=CC=C(C=C1)C(N)OC(C)=O

IUPAC: amino[4-(2-methylpropoxy)phenyl]methyl acetate

InChI: InChI=1/C13H19NO3/c1-9(2)8-16-12-6-4-11(5-7-12)13(14)17-10(3)15/h4-7,9,13H,8,14H2,1-3H3

Composition: C (65.80%), H (8.07%), N (5.90%), O (20.23%)

Molar Mass: 237.299

Atom Count: 36

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 237.136493476
Formal Charge 0
FSP3 0.46
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey WJWKKDUXDDMTDJ-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 64.92
Topological Polar Surface Area 61.55
Polarizability 26.18
Ring Count 1
Rotatable Bond Count 6

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Purity LeadTime CAS PacketSize UnitPrice
97% <14 Days 955997-89-4 $75.48-$200.94$75.48$126.48$200.94
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