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Home Nitros 2-(4-Chloro-3-nitrobenzoyl)benzoic acid

2-(4-Chloro-3-nitrobenzoyl)benzoic acid

CAS No.:
85-54-1
Catalog Number:
AG003B29
Molecular Formula:
C14H8ClNO5
Molecular Weight:
305.6700
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$13
- +
5g
95%
In Stock USA
United States
$25
- +
25g
95%
In Stock USA
United States
$63
- +
100g
95%
In Stock USA
United States
$188
- +
Product Description
Catalog Number:
AG003B29
Chemical Name:
2-(4-Chloro-3-nitrobenzoyl)benzoic acid
CAS Number:
85-54-1
Molecular Formula:
C14H8ClNO5
Molecular Weight:
305.6700
MDL Number:
MFCD00007082
IUPAC Name:
2-(4-chloro-3-nitrobenzoyl)benzoic acid
InChI:
InChI=1S/C14H8ClNO5/c15-11-6-5-8(7-12(11)16(20)21)13(17)9-3-1-2-4-10(9)14(18)19/h1-7H,(H,18,19)
InChI Key:
RITAQDHCJBLSSL-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1C(=O)O)c1ccc(c(c1)[N+](=O)[O-])Cl
EC Number:
201-613-8
NSC Number:
15366
Properties
Complexity:
436  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
305.009g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
305.67g/mol
Monoisotopic Mass:
305.009g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
100A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties