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Home Halogens 1H-Pyrazole-5-carbonyl chloride, 1-[(2,4-dichlorophenyl)methyl]-3-(1,1-dimethylethyl)-

1H-Pyrazole-5-carbonyl chloride, 1-[(2,4-dichlorophenyl)methyl]-3-(1,1-dimethylethyl)-

CAS No.:
306937-15-5
Catalog Number:
AG0030Y5
Molecular Formula:
C15H15Cl3N2O
Molecular Weight:
345.6514
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
1 week
United States
$288
- +
5g
1 week
United States
$995
- +
10g
1 week
United States
$1907
- +
Product Description
Catalog Number:
AG0030Y5
Chemical Name:
1H-Pyrazole-5-carbonyl chloride, 1-[(2,4-dichlorophenyl)methyl]-3-(1,1-dimethylethyl)-
CAS Number:
306937-15-5
Molecular Formula:
C15H15Cl3N2O
Molecular Weight:
345.6514
MDL Number:
MFCD01765431
IUPAC Name:
5-tert-butyl-2-[(2,4-dichlorophenyl)methyl]pyrazole-3-carbonyl chloride
InChI:
InChI=1S/C15H15Cl3N2O/c1-15(2,3)13-7-12(14(18)21)20(19-13)8-9-4-5-10(16)6-11(9)17/h4-7H,8H2,1-3H3
InChI Key:
HZVOAGUTHDHWSB-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)Cl)Cn1nc(cc1C(=O)Cl)C(C)(C)C
Properties
Complexity:
386  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
344.025g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
345.648g/mol
Monoisotopic Mass:
344.025g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.6  
Properties