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NITROTHAL-ISOPROPYL

CAS No.:
10552-74-6
Catalog Number:
AG008RKS
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG008RKS
Chemical Name:
NITROTHAL-ISOPROPYL
CAS Number:
10552-74-6
MDL Number:
MFCD00055456
IUPAC Name:
dipropan-2-yl 5-nitrobenzene-1,3-dicarboxylate
InChI:
InChI=1S/C14H17NO6/c1-8(2)20-13(16)10-5-11(14(17)21-9(3)4)7-12(6-10)15(18)19/h5-9H,1-4H3
InChI Key:
VJAWBEFMCIINFU-UHFFFAOYSA-N
EC Number:
234-139-5
UNII:
U6ZG3TTM2S
Properties
Complexity:
371  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.106g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
295.291g/mol
Monoisotopic Mass:
295.106g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
98.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties