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Home > Encyclopedia > 6-Amino-3,9-dihydro-2H-purin-2-one

6-Amino-3,9-dihydro-2H-purin-2-one

6-Amino-3,9-dihydro-2H-purin-2-one structure

6-Amino-3,9-dihydro-2H-purin-2-one 

structure
  • CAS No:

    149297-79-0

  • Formula:

    C5H5N5O

  • Chemical Name:

    6-Amino-3,9-dihydro-2H-purin-2-one

  • Synonyms:

    2H-Purin-2-one,6-amino-3,9-dihydro-;6-Amino-3,9-dihydro-2H-purin-2-one

Description

Solid


Isoguanine is an oxopurine that is 3,7-dihydro-purin-2-one in which the hydrogen at position 6 is substituted by an amino group.

6-Amino-3,9-dihydro-2H-purin-2-one Basic Attributes

151.13 g/mol

151.13

222-157-6

E335PK4428

241501

DTXSID00187406

Characteristics

91.9 Ų

0.00000

>360°C

0.0625 mg/mL

127 Ų [M+H]+ [CCS Type: DT, Method: single field calibrated with Agilent tune mix (Agilent)]|121.04 Ų [M-H]- [CCS Type: DT, Method: single field calibrated with Agilent tune mix (Agilent)]

Safety Information

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, and P362|Aggregated GHS information provided by 90 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

2-hydroxyadenine

Computed Properties

Molecular Weight:151.13
XLogP3:-1.7
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:2
Exact Mass:151.04940980
Monoisotopic Mass:151.04940980
Topological Polar Surface Area:91.9
Heavy Atom Count:11
Complexity:313
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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