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102437-80-9

102437-80-9 | Benzene, 1,3-bis(azidomethyl)-

CAS No: 102437-80-9 Catalog No: AG0007I1 MDL No:

Product Description

Catalog Number:
AG0007I1
Chemical Name:
Benzene, 1,3-bis(azidomethyl)-
CAS Number:
102437-80-9
Molecular Formula:
C8H8N6
Molecular Weight:
188.1893
IUPAC Name:
1,3-bis(azidomethyl)benzene
InChI:
InChI=1S/C8H8N6/c9-13-11-5-7-2-1-3-8(4-7)6-12-14-10/h1-4H,5-6H2
InChI Key:
QJVCEMKRSNTHQT-UHFFFAOYSA-N
SMILES:
[N-]=[N+]=NCc1cccc(c1)CN=[N+]=[N-]

Properties

Complexity:
237  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.081g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
188.194g/mol
Monoisotopic Mass:
188.081g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  

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