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Home > Nitro Compounds > 70833-52-2
70833-52-2 | 1-Nitro-2-tridecanol
CAS No: 70833-52-2 Catalog No: AG00FUEA MDL No:
Product Description
Catalog Number:
AG00FUEA
Chemical Name:
1-Nitro-2-tridecanol
CAS Number:
70833-52-2
IUPAC Name:
1-nitrotridecan-2-ol
InChI:
InChI=1S/C13H27NO3/c1-2-3-4-5-6-7-8-9-10-11-13(15)12-14(16)17/h13,15H,2-12H2,1H3
InChI Key:
FWVFEWHEOYAZDQ-UHFFFAOYSA-N
Properties
Complexity:
180
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.199g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
245.363g/mol
Monoisotopic Mass:
245.199g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
5
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