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tert-butyl N-[4-(chlorosulfonyl)phenyl]carbamate

tert-butyl N-[4-(chlorosulfonyl)phenyl]carbamate

CAS: 269747-25-3

Formula: C11H14ClNO4S

SMILES: CC(C)(C)OC(=O)NC1=CC=C(C=C1)S(Cl)(=O)=O

IUPAC: tert-butyl N-[4-(chlorosulfonyl)phenyl]carbamate

InChI: InChI=1S/C11H14ClNO4S/c1-11(2,3)17-10(14)13-8-4-6-9(7-5-8)18(12,15)16/h4-7H,1-3H3,(H,13,14)

Composition: C (45.29%), H (4.84%), Cl (12.15%), N (4.80%), O (21.94%), S (10.99%)

Molar Mass: 291.75

Atom Count: 32

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 291.0332068
Formal Charge 0
FSP3 0.36
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey XUKQJXYLFMTDNU-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 70.54
Topological Polar Surface Area 72.47
Polarizability 27.56
Ring Count 1
Rotatable Bond Count 4

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Key Organics Ltd
Purity LeadTime CAS PacketSize UnitPrice
97% <2 Days 269747-25-3 $270.94-$874.00$270.94$270.94$874.00$874.00
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Struchem co.,ltd
Purity LeadTime CAS PacketSize UnitPrice
95% <5 Days 269747-25-3 $834.00-$1,292.00$834.00$1,292.00
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Purity LeadTime CAS PacketSize UnitPrice
98% <5 Days 269747-25-3 $45.40-$571.23$45.40$136.19$571.23
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