Home Halogens 3-bromo-2-chloro-5-(2-nitroprop-1-en-1-yl)thiophene

3-bromo-2-chloro-5-(2-nitroprop-1-en-1-yl)thiophene

CAS No.:
1604019-06-8
Catalog Number:
AG01ELWR
Molecular Formula:
C7H5BrClNO2S
Molecular Weight:
282.5421
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Product Description
Catalog Number:
AG01ELWR
Chemical Name:
3-bromo-2-chloro-5-(2-nitroprop-1-en-1-yl)thiophene
CAS Number:
1604019-06-8
Molecular Formula:
C7H5BrClNO2S
Molecular Weight:
282.5421
MDL Number:
MFCD30074512
IUPAC Name:
3-bromo-2-chloro-5-[(E)-2-nitroprop-1-enyl]thiophene
InChI:
InChI=1S/C7H5BrClNO2S/c1-4(10(11)12)2-5-3-6(8)7(9)13-5/h2-3H,1H3/b4-2+
InChI Key:
RUPPCELDZDHUQR-DUXPYHPUSA-N
SMILES:
[O-][N+](=O)C(=Cc1cc(c(s1)Cl)Br)C
Properties
Complexity:
243  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
280.891g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
282.536g/mol
Monoisotopic Mass:
280.891g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
74.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9  
Properties