1-Nitro-7,8,9,10-tetrahydrobenzo(a)pyrene

1-nitro-7,8,9,10-tetrahydrobenzo[a]pyrene

CAS: 88598-56-5

Molecular Formula	`C20H15NO2`
Molecular Weight	301.3 g/mol
LogP	6.2
Topological Polar Surface Area	45.8 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	2
Rotatable Bonds	0
Exact Mass	301.1103
Heavy Atoms	23
Complexity	487.0

Chemical Identifiers

CAS Number	88598-56-5
SMILES	`C1CCC2=C(C1)C=C3C=CC4=C5C3=C2C=CC5=C(C=C4)[N+](=O)[O-]`
InChIKey	`GZPLNLYPOUPYOX-UHFFFAOYSA-N`

📖 Product Overview

1-Nitro-7,8,9,10-tetrahydrobenzo(a)pyrene (CAS: 88598-56-5) is a chemical compound with molecular formula C20H15NO2 and molecular weight 301.3 g/mol. Its IUPAC systematic name is 1-nitro-7,8,9,10-tetrahydrobenzo[a]pyrene. LogP 6.2 Topological Polar Surface Area 45.8 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 2 Rotatable Bonds 0 Exact Mass 301.1103 Heavy Atoms 23 Complexity 487.0 InChI Key: GZPLNLYPOUPYOX-UHFFFAOYSA-N. SMILES: C1CCC2=C(C1)C=C3C=CC4=C5C3=C2C=CC5=C(C=C4)[N+](=O)[O-].

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