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5-Benzothiazolemethanol,alpha,alpha,2-trimethyl-(7CI,8CI)

5-Benzothiazolemethanol,alpha,alpha,2-trimethyl-(7CI,8CI) structure

CAS No:
5935-85-3
Formula:
C11H13NOS
Chemical Name:
5-Benzothiazolemethanol,alpha,alpha,2-trimethyl-(7CI,8CI)
Synonyms:
DTXSID70411164;N-benzyl-N-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl]-2-phenoxyacetamide

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5-Benzothiazolemethanol,alpha,alpha,2-trimethyl-(7CI,8CI) Basic Attributes

Molecular Weight：

428.5

Exact Mass：

428.190006

DSSTox ID：

DTXSID70411164

Characteristics

PSA：

34.5

XLogP3：

5.28330

Density：

1.217±0.06 g/cm3(Predicted)

Melting Point：

83.5 °C

Boiling Point：

613.5ºC at 760 mmHg

Flash Point：

324.8ºC

Refractive Index：

1.579

Computed Properties

Molecular Weight:428.5
XLogP3:4.9
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:9
Exact Mass:428.19000621
Monoisotopic Mass:428.19000621
Topological Polar Surface Area:34.5
Heavy Atom Count:32
Complexity:554
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-Benzothiazolemethanol,alpha,alpha,2-trimethyl-(7CI,8CI)

Basic Attributes
Characteristics
Computed Properties

5-Benzothiazolemethanol,alpha,alpha,2-trimethyl-(7CI,8CI)

SDS

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