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tert-butyl 3-(2-{2-[(4-formylphenyl)formamido]ethoxy}ethoxy)propanoate

tert-butyl 3-(2-{2-[(4-formylphenyl)formamido]ethoxy}ethoxy)propanoate

CAS: 1807521-09-0

Formula: C19H27NO6

SMILES: [H]C(=O)C1=CC=C(C=C1)C(=O)NCCOCCOCCC(=O)OC(C)(C)C

IUPAC: tert-butyl 3-(2-{2-[(4-formylphenyl)formamido]ethoxy}ethoxy)propanoate

InChI: InChI=1S/C19H27NO6/c1-19(2,3)26-17(22)8-10-24-12-13-25-11-9-20-18(23)16-6-4-15(14-21)5-7-16/h4-7,14H,8-13H2,1-3H3,(H,20,23)

Composition: C (62.45%), H (7.45%), N (3.83%), O (26.27%)

Molar Mass: 365.426

Atom Count: 53

Heavy Atom Count: 26

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 365.183837593
Formal Charge 0
FSP3 0.53
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 1
InChIKey UXMPBIQFYCJYBB-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 98.06
Topological Polar Surface Area 90.93
Polarizability 37.52
Ring Count 1
Rotatable Bond Count 13

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Purity (%)
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Ships Within
Days
Packet Size
Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 1807521-09-0 $302.40-$708.75$302.40$453.60$708.75
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