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4-CHLORO-QUINAZOLINE

4-CHLORO-QUINAZOLINE structure

CAS No:
5190-68-1
Formula:
C8H5ClN2
Chemical Name:
4-CHLORO-QUINAZOLINE
Synonyms:
AKOSBBS-00004561;4-Chloroquinozoline;4-CHLORO-QUINAZOLINE;4-Chloroquinazoline97%
Categories:
Specialty Chemicals

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4-CHLORO-QUINAZOLINE Basic Attributes

Molecular Weight：

164.59

Exact Mass：

164.014130

NSC Number：

53480

DSSTox ID：

DTXSID40199866

HScode：

2933990090

Characteristics

PSA：

25.8

XLogP3：

1.9

Density：

1.4±0.1 g/cm3

Melting Point：

96-100ºC

Boiling Point：

281.0±13.0°C at 760 mmHg

Flash Point：

150.6±5.4 °C

Refractive Index：

1.663

Safety Information

Transport codes：

UN 2811

wgk germany：

hazard class code：

R25;R37/38;R41

safety instructions：

S26-S39-S45

Marks：

Xi: Irritant;

Precautionary statement(s)：

P261-P280-P301 + P310-P305 + P351 + P338

Hazard Statements：

H301-H315-H318-H335

GHS Classification：

|Danger|H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 40 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:164.59
XLogP3:1.9
Hydrogen Bond Acceptor Count:2
Exact Mass:164.0141259
Monoisotopic Mass:164.0141259
Topological Polar Surface Area:25.8
Heavy Atom Count:11
Complexity:140
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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