Home Carboxys methyl 2,3-dihydro-1H-isoindole-2-carboxylate

methyl 2,3-dihydro-1H-isoindole-2-carboxylate

CAS No.:
18913-40-1
Catalog Number:
AG01ACNT
Molecular Formula:
C10H11NO2
Molecular Weight:
177.1998
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Product Description
Catalog Number:
AG01ACNT
Chemical Name:
methyl 2,3-dihydro-1H-isoindole-2-carboxylate
CAS Number:
18913-40-1
Molecular Formula:
C10H11NO2
Molecular Weight:
177.1998
MDL Number:
MFCD09966070
IUPAC Name:
methyl 1,3-dihydroisoindole-2-carboxylate
InChI:
InChI=1S/C10H11NO2/c1-13-10(12)11-6-8-4-2-3-5-9(8)7-11/h2-5H,6-7H2,1H3
InChI Key:
MXJHXCYTXQSSCT-UHFFFAOYSA-N
SMILES:
COC(=O)N1Cc2c(C1)cccc2
Properties
Complexity:
191  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.079g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
177.203g/mol
Monoisotopic Mass:
177.079g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties