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2-(5-tert-butyl-1-chloro-1,3,3-trimethyl-2,1λ4-benzoxathiol-7-yl)propan-2-ol

2-(5-tert-butyl-1-chloro-1,3,3-trimethyl-2,1λ4-benzoxathiol-7-yl)propan-2-ol structure

CAS No:
65434-56-2
Formula:
C17H27ClO2S
Chemical Name:
2-(5-tert-butyl-1-chloro-1,3,3-trimethyl-2,1λ4-benzoxathiol-7-yl)propan-2-ol
Synonyms:
NSC299849;65434-56-2;3H-2,1-Benzoxathiole-7-methanol, 1-chloro-5-(1,1-dimethylethyl)-1,1-dihydro-alpha,alpha,1,3,3-pentamethyl-;NSC 299849;UNII-E1E3L7MN30;E1E3L7MN30;DTXSID50215763;ZINC104202638;NSC-299849;2-(5-tert-butyl-1-chloro-1,3,3-trimethyl-2,1$l^{4}-benzoxathiol-7-yl)propan-2-ol;1-Chloro-5-(1,1-dimethylethyl)-1,1-dihydro-alpha,alpha,1,3,3-pentamethyl-3H-2,1-benzoxathiole-7-methanol

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2-(5-tert-butyl-1-chloro-1,3,3-trimethyl-2,1λ4-benzoxathiol-7-yl)propan-2-ol Basic Attributes

Molecular Weight：

330.9 g/mol

Exact Mass：

330.1420290 g/mol

NSC Number：

299849

DSSTox ID：

DTXSID50215763

Characteristics

PSA：

30.5 Å²

Computed Properties

Molecular Weight:330.9
XLogP3:4.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:330.1420290
Monoisotopic Mass:330.1420290
Topological Polar Surface Area:30.5
Heavy Atom Count:21
Complexity:416
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-(5-tert-butyl-1-chloro-1,3,3-trimethyl-2,1λ4-benzoxathiol-7-yl)propan-2-ol

Basic Attributes
Characteristics
Computed Properties

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