Home Nitros 2-[(5-nitro-1,3-thiazol-2-yl)carbamoyl]phenyl acetate

2-[(5-nitro-1,3-thiazol-2-yl)carbamoyl]phenyl acetate

CAS No.:
55981-09-4
Catalog Number:
AG00I9ZK
Molecular Formula:
C12H9N3O5S
Molecular Weight:
307.2820
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$13
- +
5g
98%
In Stock USA
United States
$32
- +
25g
98%
In Stock USA
United States
$75
- +
100g
98%
In Stock USA
United States
$188
- +
500g
98%
In Stock USA
United States
$550
- +
Product Description
Catalog Number:
AG00I9ZK
Chemical Name:
2-[(5-nitro-1,3-thiazol-2-yl)carbamoyl]phenyl acetate
CAS Number:
55981-09-4
Molecular Formula:
C12H9N3O5S
Molecular Weight:
307.2820
MDL Number:
MFCD00416599
IUPAC Name:
[2-[(5-nitro-1,3-thiazol-2-yl)carbamoyl]phenyl] acetate
InChI:
InChI=1S/C12H9N3O5S/c1-7(16)20-9-5-3-2-4-8(9)11(17)14-12-13-6-10(21-12)15(18)19/h2-6H,1H3,(H,13,14,17)
InChI Key:
YQNQNVDNTFHQSW-UHFFFAOYSA-N
SMILES:
CC(=O)Oc1ccccc1C(=O)Nc1ncc(s1)[N+](=O)[O-]
EC Number:
259-931-8
UNII:
SOA12P041N
Properties
Complexity:
428  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
307.026g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
307.28g/mol
Monoisotopic Mass:
307.026g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
142A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
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