Home Carboxys Methyl 3-iodo-1H-indole-7-carboxylate

Methyl 3-iodo-1H-indole-7-carboxylate

CAS No.:
1788043-93-5
Catalog Number:
AG00HZWK
Molecular Formula:
C10H8INO2
Molecular Weight:
301.0805
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Product Description
Catalog Number:
AG00HZWK
Chemical Name:
Methyl 3-iodo-1H-indole-7-carboxylate
CAS Number:
1788043-93-5
Molecular Formula:
C10H8INO2
Molecular Weight:
301.0805
MDL Number:
MFCD28501544
IUPAC Name:
methyl 3-iodo-1H-indole-7-carboxylate
InChI:
InChI=1S/C10H8INO2/c1-14-10(13)7-4-2-3-6-8(11)5-12-9(6)7/h2-5,12H,1H3
InChI Key:
QHKCXKOTFXOTCP-UHFFFAOYSA-N
SMILES:
COC(=O)c1cccc2c1[nH]cc2I
Properties
Complexity:
234  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
300.96g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
301.083g/mol
Monoisotopic Mass:
300.96g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
42.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties