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69614-95-5 | 4-(2-Chloroethyl)acetophenone, tech. 90%
CAS No: 69614-95-5 Catalog No: AG003JZG MDL No:MFCD00016350
Product Description
Catalog Number:
AG003JZG
Chemical Name:
4-(2-Chloroethyl)acetophenone, tech. 90%
CAS Number:
69614-95-5
Molecular Formula:
C10H11ClO
Molecular Weight:
182.6467
MDL Number:
MFCD00016350
IUPAC Name:
1-[4-(2-chloroethyl)phenyl]ethanone
InChI:
InChI=1S/C10H11ClO/c1-8(12)10-4-2-9(3-5-10)6-7-11/h2-5H,6-7H2,1H3
InChI Key:
RGVUACHOYCYNMB-UHFFFAOYSA-N
SMILES:
ClCCc1ccc(cc1)C(=O)C
Properties
Complexity:
148
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.05g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
182.647g/mol
Monoisotopic Mass:
182.05g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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