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Home > Nitro Compounds > 299425-72-2
299425-72-2 | 1-(2-Nitrophenyl)-1,4-diazepane, HCl
CAS No: 299425-72-2 Catalog No: AG00I5K9 MDL No:
Product Description
Catalog Number:
AG00I5K9
Chemical Name:
1-(2-Nitrophenyl)-1,4-diazepane, HCl
CAS Number:
299425-72-2
IUPAC Name:
1-(2-nitrophenyl)-1,4-diazepane;hydrochloride
InChI:
InChI=1S/C11H15N3O2.ClH/c15-14(16)11-5-2-1-4-10(11)13-8-3-6-12-7-9-13;/h1-2,4-5,12H,3,6-9H2;1H
InChI Key:
MWALCTDTDPXCTI-UHFFFAOYSA-N
Properties
Complexity:
242
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.093g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
257.718g/mol
Monoisotopic Mass:
257.093g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
61.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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