2-Methyl-4-(9H-purin-6-ylamino)-2-buten-1-ol
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2-Methyl-4-(9H-purin-6-ylamino)-2-buten-1-ol
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CAS No:
13114-27-7
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Formula:
C10H13N5O
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Chemical Name:
2-Methyl-4-(9H-purin-6-ylamino)-2-buten-1-ol
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Synonyms:
2-Buten-1-ol,2-methyl-4-(9H-purin-6-ylamino)-;2-Buten-1-ol,2-methyl-4-(purin-6-ylamino)-;2-Buten-1-ol,2-methyl-4-(1H-purin-6-ylamino)-;2-Methyl-4-(9H-purin-6-ylamino)-2-buten-1-ol;2-Methyl-4-(7H-purin-6-ylamino)but-2-en-1-ol
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CAS No:
Characteristics
86.72000
-1.02
off-white to yellow powder
1.40±0.1 g/cm3(Predicted)
395.0±52.0 °C(Predicted)
192.7±30.7 °C
1.684
−20°C
Computed Properties
Molecular Weight:219.24
XLogP3:0.7
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:219.11201006
Monoisotopic Mass:219.11201006
Topological Polar Surface Area:86.7
Heavy Atom Count:16
Complexity:258
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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2-Methyl-4-(9H-purin-6-ylamino)-2-buten-1-ol
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