4-(chlorosulfonyl)phenyl 2,2-dimethylpropanoate

4-(chlorosulfonyl)phenyl 2,2-dimethylpropanoate

CAS: 150374-99-5

Formula: C11H13ClO4S

SMILES: CC(C)(C)C(=O)OC1=CC=C(C=C1)S(Cl)(=O)=O

IUPAC: 4-(chlorosulfonyl)phenyl 2,2-dimethylpropanoate

InChI: InChI=1S/C11H13ClO4S/c1-11(2,3)10(13)16-8-4-6-9(7-5-8)17(12,14)15/h4-7H,1-3H3

Composition: C (47.74%), H (4.74%), Cl (12.81%), O (23.13%), S (11.59%)

Molar Mass: 276.73

Atom Count: 30

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	276.0223078
Formal Charge	0
FSP3	0.36
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	BSRSTUAZWZWGRT-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	65.09
Topological Polar Surface Area	60.44
Polarizability	26.39
Ring Count	1
Rotatable Bond Count	4

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