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124655-63-6

124655-63-6 | 1H-Pyrrolizine-7a(5H)-acetic acid, tetrahydro-, hydrochloride (1:1)

CAS No: 124655-63-6 Catalog No: AG000MJN MDL No:MFCD09032985

Product Description

Catalog Number:
AG000MJN
Chemical Name:
1H-Pyrrolizine-7a(5H)-acetic acid, tetrahydro-, hydrochloride (1:1)
CAS Number:
124655-63-6
Molecular Formula:
C9H16ClNO2
Molecular Weight:
205.6818
MDL Number:
MFCD09032985
IUPAC Name:
2-(1,2,3,5,6,7-hexahydropyrrolizin-8-yl)acetic acid;hydrochloride
InChI:
InChI=1S/C9H15NO2.ClH/c11-8(12)7-9-3-1-5-10(9)6-2-4-9;/h1-7H2,(H,11,12);1H
InChI Key:
XEZNJLFXMUJHTN-UHFFFAOYSA-N
SMILES:
OC(=O)CC12CCCN2CCC1.Cl
EC Number:
603-003-0

Properties

Complexity:
193  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.087g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
205.682g/mol
Monoisotopic Mass:
205.087g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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