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4-(heptyloxy)aniline

4-(heptyloxy)aniline

CAS: 39905-44-7

Formula: C13H21NO

SMILES: CCCCCCCOC1=CC=C(N)C=C1

IUPAC: 4-(heptyloxy)aniline

InChI: InChI=1S/C13H21NO/c1-2-3-4-5-6-11-15-13-9-7-12(14)8-10-13/h7-10H,2-6,11,14H2,1H3

Composition: C (75.32%), H (10.21%), N (6.76%), O (7.72%)

Molar Mass: 207.317

Atom Count: 36

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 207.1623143
Formal Charge 0
FSP3 0.54
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey LTGYTOOKQWFTQG-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 64.9
Topological Polar Surface Area 35.25
Polarizability 25.06
Ring Count 1
Rotatable Bond Count 7

Suppliers

Purity (%)
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AA BLOCKS INC
Purity LeadTime CAS PacketSize UnitPrice
96% <6 Days 39905-44-7 $23.00-$2,305.75$23.00$52.90$177.10$494.50$2,305.75
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Frinton Laboratories, Inc.
Purity LeadTime CAS PacketSize UnitPrice
95% <10 Days 39905-44-7 $58.50$58.50
Liquid crystal intermediate, keep cold
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Molecule Market Select
Purity LeadTime CAS PacketSize UnitPrice
98% <7 Days 39905-44-7 $70.38-$729.68$70.38$208.04$729.68
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