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methyl 4-(4-aminophenyl)butanoate

methyl 4-(4-aminophenyl)butanoate

CAS: 20637-09-6

Formula: C11H15NO2

SMILES: COC(=O)CCCC1=CC=C(N)C=C1

IUPAC: methyl 4-(4-aminophenyl)butanoate

InChI: InChI=1S/C11H15NO2/c1-14-11(13)4-2-3-9-5-7-10(12)8-6-9/h5-8H,2-4,12H2,1H3

Composition: C (68.37%), H (7.82%), N (7.25%), O (16.56%)

Molar Mass: 193.246

Atom Count: 29

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 193.110278727
Formal Charge 0
FSP3 0.36
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey CLKHQWJXESOLCJ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 56.04
Topological Polar Surface Area 52.32
Polarizability 21.44
Ring Count 1
Rotatable Bond Count 5

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Purity LeadTime CAS PacketSize UnitPrice
98% <7 Days 20637-09-6 $8.28-$445.05$8.28$14.49$33.12$110.75$185.27$445.05
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Purity LeadTime CAS PacketSize UnitPrice
97% <6 Days 20637-09-6 $14.95-$303.60$14.95$26.45$47.15$171.35$303.60
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Purity LeadTime CAS PacketSize UnitPrice
97% <5 Days 20637-09-6 $18.92-$394.69$18.92$34.05$60.53$221.94$394.69
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