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122-35-0 | Propanoyl chloride, 2-phenoxy-
CAS No: 122-35-0 Catalog No: AG0016JG MDL No:MFCD00018810
Product Description
Catalog Number:
AG0016JG
Chemical Name:
Propanoyl chloride, 2-phenoxy-
CAS Number:
122-35-0
Molecular Formula:
C9H9ClO2
Molecular Weight:
184.6196
MDL Number:
MFCD00018810
IUPAC Name:
2-phenoxypropanoyl chloride
InChI:
InChI=1S/C9H9ClO2/c1-7(9(10)11)12-8-5-3-2-4-6-8/h2-7H,1H3
InChI Key:
BDSSZTXPZHIYHM-UHFFFAOYSA-N
SMILES:
CC(C(=O)Cl)Oc1ccccc1
EC Number:
204-536-8
NSC Number:
9825
Properties
Complexity:
153
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.029g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
184.619g/mol
Monoisotopic Mass:
184.029g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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