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101383-04-4 | 1,3-Benzenediol, 4-(2-hydroxyethyl)-2,6-dimethyl-
CAS No: 101383-04-4 Catalog No: AG0004CS MDL No:
Product Description
Catalog Number:
AG0004CS
Chemical Name:
1,3-Benzenediol, 4-(2-hydroxyethyl)-2,6-dimethyl-
CAS Number:
101383-04-4
Molecular Formula:
C10H14O3
Molecular Weight:
182.2164
IUPAC Name:
4-(2-hydroxyethyl)-2,6-dimethylbenzene-1,3-diol
InChI:
InChI=1S/C10H14O3/c1-6-5-8(3-4-11)10(13)7(2)9(6)12/h5,11-13H,3-4H2,1-2H3
InChI Key:
VTFNHORKLKHVFY-UHFFFAOYSA-N
SMILES:
OCCc1cc(C)c(c(c1O)C)O
Properties
Complexity:
160
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.094g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
182.219g/mol
Monoisotopic Mass:
182.094g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
60.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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