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1,4,8,11-Tetrakis[(4-methylphenyl)sulfonyl]-1,4,8,11-tetraazacyclotetradecane

1,4,8,11-Tetrakis[(4-methylphenyl)sulfonyl]-1,4,8,11-tetraazacyclotetradecane structure

CAS No:
71089-74-2
Formula:
C38H48N4O8S4
Chemical Name:
1,4,8,11-Tetrakis[(4-methylphenyl)sulfonyl]-1,4,8,11-tetraazacyclotetradecane
Synonyms:
1,4,8,11-Tetraazacyclotetradecane,1,4,8,11-tetrakis[(4-methylphenyl)sulfonyl]-;1,4,8,11-Tetraazacyclotetradecane,1,4,8,11-tetrakis(p-tolylsulfonyl)-;1,4,8,11-Tetrakis[(4-methylphenyl)sulfonyl]-1,4,8,11-tetraazacyclotetradecane;1,4,8,11-Tetratosyl-1,4,8,11-tetraazacyclotetradecane;1187178-73-9

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1,4,8,11-Tetrakis[(4-methylphenyl)sulfonyl]-1,4,8,11-tetraazacyclotetradecane Basic Attributes

Molecular Weight：

817.07000

Exact Mass：

817.07

EC Number：

615-249-6

DSSTox ID：

DTXSID80389067

Characteristics

PSA：

183.04000

XLogP3：

8.85220

Density：

1.303g/cm3

Melting Point：

284-287 °C

Boiling Point：

916.9ºC

Refractive Index：

1.6

Computed Properties

Molecular Weight:817.1
XLogP3:5.5
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:8
Exact Mass:816.23549920
Monoisotopic Mass:816.23549920
Topological Polar Surface Area:183
Heavy Atom Count:54
Complexity:1360
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1,4,8,11-Tetrakis[(4-methylphenyl)sulfonyl]-1,4,8,11-tetraazacyclotetradecane

Basic Attributes
Characteristics
Computed Properties

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