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100238-55-9 | Phenol, 4-(2-chloroethoxy)-
CAS No: 100238-55-9 Catalog No: AG0001CB MDL No:MFCD08447755
Product Description
Catalog Number:
AG0001CB
Chemical Name:
Phenol, 4-(2-chloroethoxy)-
CAS Number:
100238-55-9
Molecular Formula:
C8H9ClO2
Molecular Weight:
172.6089
MDL Number:
MFCD08447755
IUPAC Name:
4-(2-chloroethoxy)phenol
InChI:
InChI=1S/C8H9ClO2/c9-5-6-11-8-3-1-7(10)2-4-8/h1-4,10H,5-6H2
InChI Key:
YMIYHUNATGXCNV-UHFFFAOYSA-N
SMILES:
ClCCOc1ccc(cc1)O
EC Number:
600-043-0
Properties
Complexity:
100
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.029g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
172.608g/mol
Monoisotopic Mass:
172.029g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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