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2,5-dichloro-4-nitrophenol

2,5-dichloro-4-nitrophenol

CAS: 5847-57-4

Formula: C6H3Cl2NO3

SMILES: OC1=CC(Cl)=C(C=C1Cl)[N+]([O-])=O

IUPAC: 2,5-dichloro-4-nitrophenol

InChI: InChI=1S/C6H3Cl2NO3/c7-3-2-6(10)4(8)1-5(3)9(11)12/h1-2,10H

Composition: C (34.65%), H (1.45%), Cl (34.09%), N (6.73%), O (23.08%)

Molar Mass: 207.99

Atom Count: 15

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 206.9489984
Formal Charge 0
FSP3 0
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey BWQWBOCFVUBGEF-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 43.97
Topological Polar Surface Area 63.37
Polarizability 16.85
Ring Count 1
Rotatable Bond Count 1

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Key Organics Ltd
Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 5847-57-4 $238.17-$582.30$238.17$238.17$582.30$582.30
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Molecule Market Select
Purity LeadTime CAS PacketSize UnitPrice
98% <5 Days 5847-57-4 $25.22-$127.36$25.22$61.79$127.36
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