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4878-29-9

4878-29-9 | 2-Methyl-2-(4-nitrophenoxy)propanoyl chloride

CAS No: 4878-29-9 Catalog No: AG01E7W1 MDL No:

Product Description

Catalog Number:
AG01E7W1
Chemical Name:
2-Methyl-2-(4-nitrophenoxy)propanoyl chloride
CAS Number:
4878-29-9
Molecular Formula:
C10H10ClNO4
Molecular Weight:
243.6437
IUPAC Name:
2-methyl-2-(4-nitrophenoxy)propanoyl chloride
InChI:
InChI=1S/C10H10ClNO4/c1-10(2,9(11)13)16-8-5-3-7(4-6-8)12(14)15/h3-6H,1-2H3
InChI Key:
FEQKLTOBQAFPHM-UHFFFAOYSA-N
SMILES:
ClC(=O)C(Oc1ccc(cc1)[N+](=O)[O-])(C)C

Properties

Complexity:
279  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.03g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
243.643g/mol
Monoisotopic Mass:
243.03g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
72.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  

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