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2-Sulfanyl-5,6,7,8-tetrahydro-4-quinazolinol

2-Sulfanyl-5,6,7,8-tetrahydro-4-quinazolinol structure

CAS No:
16064-21-4
Formula:
C8H10N2OS
Chemical Name:
2-Sulfanyl-5,6,7,8-tetrahydro-4-quinazolinol
Synonyms:
2-Thioxo-2,3,5,6,7,8-hexahydroquinazolin-4(1H)-one; 2-Thioxo-2,3,5,6,7,8-hexahydro-4(1H)-quinazolinone; 4(1H)-Quinazolinone, 2,3,5,6,7,8-hexahydro-2-thioxo-; 2-sulfanylidene-5,6,7,8-tetrahydro-1H-quinazolin-4-one;

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2-Sulfanyl-5,6,7,8-tetrahydro-4-quinazolinol Basic Attributes

Molecular Weight：

182.24300

Exact Mass：

182.05138412

DSSTox ID：

DTXSID60371440

HScode：

2933990090

Characteristics

PSA：

84.81000

XLogP3：

1.34970

Density：

1.35g/cm3

Melting Point：

337-339ºC

Boiling Point：

398.6ºC at 760mmHg

Flash Point：

194.9ºC

Refractive Index：

1.648

Vapor Pressure：

6.33E-07mmHg at 25°C

Safety Information

Marks：

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:182.25
XLogP3:0.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Exact Mass:182.05138412
Monoisotopic Mass:182.05138412
Topological Polar Surface Area:73.2
Heavy Atom Count:12
Complexity:283
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-Sulfanyl-5,6,7,8-tetrahydro-4-quinazolinol

Basic Attributes
Characteristics
Safety Information
Computed Properties

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