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1-azido-17-[(4-methylbenzenesulfonyl)oxy]-3,6,9,12,15-pentaoxaheptadecane

1-azido-17-[(4-methylbenzenesulfonyl)oxy]-3,6,9,12,15-pentaoxaheptadecane

CAS: 906007-10-1

Formula: C19H31N3O8S

SMILES: CC1=CC=C(C=C1)S(=O)(=O)OCCOCCOCCOCCOCCOCCN=[N+]=[N-]

IUPAC: 1-azido-17-[(4-methylbenzenesulfonyl)oxy]-3,6,9,12,15-pentaoxaheptadecane

InChI: InChI=1S/C19H31N3O8S/c1-18-2-4-19(5-3-18)31(23,24)30-17-16-29-15-14-28-13-12-27-11-10-26-9-8-25-7-6-21-22-20/h2-5H,6-17H2,1H3

Composition: C (49.45%), H (6.77%), N (9.10%), O (27.73%), S (6.95%)

Molar Mass: 461.53

Atom Count: 62

Heavy Atom Count: 31

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 461.183186144
Formal Charge 0
FSP3 0.68
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 9
Hydrogen Bond Donor Count 0
InChIKey DZQISMWOKQMODJ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 114.01
Topological Polar Surface Area 118.95
Polarizability 44.91
Ring Count 1
Rotatable Bond Count 20

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Purity LeadTime CAS PacketSize UnitPrice
95% <5 Days 906007-10-1 $868.00-$2,030.00$868.00$2,030.00
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Purity LeadTime CAS PacketSize UnitPrice
95% <5 Days 906007-10-1 $868.00-$2,030.00$868.00$2,030.00
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Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 906007-10-1 $359.10-$897.75$359.10$614.25$897.75
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