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1023817-19-7

1023817-19-7 | Pyrrolo[3,4-c]pyrrole, 1,2,3,5-tetrahydro-2-(phenylmethyl)-

CAS No: 1023817-19-7 Catalog No: AG0007AW MDL No:MFCD09881386

Product Description

Catalog Number:
AG0007AW
Chemical Name:
Pyrrolo[3,4-c]pyrrole, 1,2,3,5-tetrahydro-2-(phenylmethyl)-
CAS Number:
1023817-19-7
Molecular Formula:
C13H14N2
Molecular Weight:
198.2637
MDL Number:
MFCD09881386
IUPAC Name:
5-benzyl-4,6-dihydro-2H-pyrrolo[3,4-c]pyrrole
InChI:
InChI=1S/C13H14N2/c1-2-4-11(5-3-1)8-15-9-12-6-14-7-13(12)10-15/h1-7,14H,8-10H2
InChI Key:
AOLIWLMSYSVPHA-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)CN1Cc2c(C1)c[nH]c2

Properties

Complexity:
199  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.116g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
198.269g/mol
Monoisotopic Mass:
198.116g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
19A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  

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