1,3-Benzenediol, 5-methyl-, monohydrate


Chemical Name: 1,3-Benzenediol, 5-methyl-, monohydrate
CAS Number: 6153-39-5
Product Number: AG00IAVU(AGN-PC-0KP09T)
Synonyms:
MDL No:
Molecular Formula: C7H10O3
Molecular Weight: 142.1525

Identification/Properties


Computed Properties
Molecular Weight:
142.154g/mol
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
0
Exact Mass:
142.063g/mol
Monoisotopic Mass:
142.063g/mol
Topological Polar Surface Area:
41.5A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
82.9
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
2
Compound Is Canonicalized:
Yes

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NMR Spectrum


Other Analytical Data


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