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tert-butyl N-{6-[(4-methylbenzenesulfonyl)oxy]hexyl}carbamate

tert-butyl N-{6-[(4-methylbenzenesulfonyl)oxy]hexyl}carbamate

CAS: 86536-92-7

Formula: C18H29NO5S

SMILES: CC1=CC=C(C=C1)S(=O)(=O)OCCCCCCNC(=O)OC(C)(C)C

IUPAC: tert-butyl N-{6-[(4-methylbenzenesulfonyl)oxy]hexyl}carbamate

InChI: InChI=1S/C18H29NO5S/c1-15-9-11-16(12-10-15)25(21,22)23-14-8-6-5-7-13-19-17(20)24-18(2,3)4/h9-12H,5-8,13-14H2,1-4H3,(H,19,20)

Composition: C (58.20%), H (7.87%), N (3.77%), O (21.53%), S (8.63%)

Molar Mass: 371.49

Atom Count: 54

Heavy Atom Count: 25

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 371.176644212
Formal Charge 0
FSP3 0.61
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey YHHYHFYVSNWGRQ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 97.74
Topological Polar Surface Area 81.7
Polarizability 39.1
Ring Count 1
Rotatable Bond Count 11

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Purity LeadTime CAS UnitPrice
98% <10 Days 86536-92-7 Quote Only
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Purity LeadTime CAS PacketSize UnitPrice
95% <5 Days 86536-92-7 $74.40-$350.56$74.40$126.10$350.56
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