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145041-27-6

145041-27-6 | 1H-Pyrrole-1-acetic acid, 2-(aminomethyl)-

CAS No: 145041-27-6 Catalog No: AG001KHW MDL No:

Product Description

Catalog Number:
AG001KHW
Chemical Name:
1H-Pyrrole-1-acetic acid, 2-(aminomethyl)-
CAS Number:
145041-27-6
Molecular Formula:
C7H10N2O2
Molecular Weight:
154.1665
IUPAC Name:
2-[2-(aminomethyl)pyrrol-1-yl]acetic acid
InChI:
InChI=1S/C7H10N2O2/c8-4-6-2-1-3-9(6)5-7(10)11/h1-3H,4-5,8H2,(H,10,11)
InChI Key:
AKGXOKCYOMZMKB-UHFFFAOYSA-N
SMILES:
NCc1cccn1CC(=O)O

Properties

Complexity:
149  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.074g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
154.169g/mol
Monoisotopic Mass:
154.074g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
68.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-3  

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