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2,6-diamino-5-chloro-1H-pyrimidin-4-one

2,6-diamino-5-chloro-1H-pyrimidin-4-one structure

CAS No:
71552-22-2
Formula:
C4H5ClN4O
Chemical Name:
2,6-diamino-5-chloro-1H-pyrimidin-4-one
Synonyms:
2,4-Diamino-5-chloro-6-hydroxypyrimidine; 2,6-Diamino-5-chlor-3H-pyrimidin-4-on; 2,6-Diamino-5-chloro-4-pyrimidinol; 2,6-diamino-5-chloro-3H-pyrimidin-4-one; 2,6-diamino-5-chloropyrimidin-4-ol;

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2,6-diamino-5-chloro-1H-pyrimidin-4-one Basic Attributes

Molecular Weight：

160.56200

Exact Mass：

160.0151885

NSC Number：

403356

DSSTox ID：

DTXSID60323207

HScode：

2933599090

Characteristics

PSA：

97.79000

XLogP3：

0.75010

Density：

2.06g/cm3

Boiling Point：

258ºC at 760 mmHg

Flash Point：

109.8ºC

Refractive Index：

1.817

Safety Information

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P312, P322, P330, P363, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:160.56
XLogP3:-0.9
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:3
Exact Mass:160.0151885
Monoisotopic Mass:160.0151885
Topological Polar Surface Area:93.5
Heavy Atom Count:10
Complexity:244
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2,6-diamino-5-chloro-1H-pyrimidin-4-one

Basic Attributes
Characteristics
Safety Information
Computed Properties

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