Home Sulfos tert-butyl N-[4-(chlorosulfonyl)-3-methylphenyl]carbamate

tert-butyl N-[4-(chlorosulfonyl)-3-methylphenyl]carbamate

CAS No.:
1508885-92-4
Catalog Number:
AG01EIY7
Molecular Formula:
C12H16ClNO4S
Molecular Weight:
305.7777
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Product Description
Catalog Number:
AG01EIY7
Chemical Name:
tert-butyl N-[4-(chlorosulfonyl)-3-methylphenyl]carbamate
CAS Number:
1508885-92-4
Molecular Formula:
C12H16ClNO4S
Molecular Weight:
305.7777
MDL Number:
MFCD25010828
IUPAC Name:
tert-butyl N-(4-chlorosulfonyl-3-methylphenyl)carbamate
InChI:
InChI=1S/C12H16ClNO4S/c1-8-7-9(5-6-10(8)19(13,16)17)14-11(15)18-12(2,3)4/h5-7H,1-4H3,(H,14,15)
InChI Key:
YJXNTDXROIYOBH-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)Nc1ccc(c(c1)C)S(=O)(=O)Cl
Properties
Complexity:
424  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
305.049g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
305.773g/mol
Monoisotopic Mass:
305.049g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
80.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties