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210304-75-9 | Benzoyl chloride, 4-[[2-(dimethylamino)ethoxy]phenylmethyl]-
CAS No: 210304-75-9 Catalog No: AG002KP2 MDL No:
Product Description
Catalog Number:
AG002KP2
Chemical Name:
Benzoyl chloride, 4-[[2-(dimethylamino)ethoxy]phenylmethyl]-
CAS Number:
210304-75-9
Molecular Formula:
C18H20ClNO2
Molecular Weight:
317.8099
IUPAC Name:
4-[2-(dimethylamino)ethoxy-phenylmethyl]benzoyl chloride
InChI:
InChI=1S/C18H20ClNO2/c1-20(2)12-13-22-17(14-6-4-3-5-7-14)15-8-10-16(11-9-15)18(19)21/h3-11,17H,12-13H2,1-2H3
InChI Key:
LKSCARBPFPZGDN-UHFFFAOYSA-N
SMILES:
CN(CCOC(c1ccccc1)c1ccc(cc1)C(=O)Cl)C
Properties
Complexity:
334
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
317.118g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
317.813g/mol
Monoisotopic Mass:
317.118g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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