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129-00-0

129-00-0 | Pyrene

CAS No: 129-00-0 Catalog No: AG000YR2 MDL No:MFCD00004136

Product Description

Catalog Number:
AG000YR2
Chemical Name:
Pyrene
CAS Number:
129-00-0
Molecular Formula:
C16H10
Molecular Weight:
202.2506
MDL Number:
MFCD00004136
IUPAC Name:
pyrene
InChI:
InChI=1S/C16H10/c1-3-11-7-9-13-5-2-6-14-10-8-12(4-1)15(11)16(13)14/h1-10H
InChI Key:
BBEAQIROQSPTKN-UHFFFAOYSA-N
SMILES:
c1cc2ccc3c4c2c(c1)ccc4ccc3
EC Number:
204-927-3
UNII:
9E0T7WFW93
RTECS Number:
UR2450000
UN Number:
3082

Properties

Complexity:
217  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.078g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
202.256g/mol
Monoisotopic Mass:
202.078g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9  

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