1,3-Benzenediol, monoacetate


Chemical Name: 1,3-Benzenediol, monoacetate
CAS Number: 102-29-4
Product Number: AG00068X(AGN-PC-09TFFC)
Synonyms:
MDL No:
Molecular Formula: C8H8O3
Molecular Weight: 152.1473

Identification/Properties


Properties
BP:
283.0°C
Computed Properties
Molecular Weight:
152.149g/mol
XLogP3:
1.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
152.047g/mol
Monoisotopic Mass:
152.047g/mol
Topological Polar Surface Area:
46.5A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
144
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:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Danger
UN#:
3082
Hazard Statements:
H302-H315-H317-H318-H370-H410
Precautionary Statements:
P260-P273-P280-P305+P351+P338+P310-P308+P311-P333+P313
Class:
9
Packing Group:

NMR Spectrum


Other Analytical Data


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