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1268390-67-5

1268390-67-5 | 1H-Pyrrolo[2,3-b]pyridine, 4-(chloromethyl)-

CAS No: 1268390-67-5 Catalog No: AG000TC3 MDL No:MFCD20527501

Product Description

Catalog Number:
AG000TC3
Chemical Name:
1H-Pyrrolo[2,3-b]pyridine, 4-(chloromethyl)-
CAS Number:
1268390-67-5
Molecular Formula:
C8H7ClN2
Molecular Weight:
166.6076
MDL Number:
MFCD20527501
IUPAC Name:
4-(chloromethyl)-1H-pyrrolo[2,3-b]pyridine
InChI:
InChI=1S/C8H7ClN2/c9-5-6-1-3-10-8-7(6)2-4-11-8/h1-4H,5H2,(H,10,11)
InChI Key:
TYFNNVHCLAPKKE-UHFFFAOYSA-N
SMILES:
ClCc1ccnc2c1cc[nH]2

Properties

Complexity:
140  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.03g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
166.608g/mol
Monoisotopic Mass:
166.03g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  

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