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117375-15-2 | 1H-Pyrrolizine-7a(5H)-carboxylic acid, tetrahydro-, methyl ester
CAS No: 117375-15-2 Catalog No: AG000E65 MDL No:MFCD10699450
Product Description
Catalog Number:
AG000E65
Chemical Name:
1H-Pyrrolizine-7a(5H)-carboxylic acid, tetrahydro-, methyl ester
CAS Number:
117375-15-2
Molecular Formula:
C9H15NO2
Molecular Weight:
169.2209
MDL Number:
MFCD10699450
IUPAC Name:
methyl 1,2,3,5,6,7-hexahydropyrrolizine-8-carboxylate
InChI:
InChI=1S/C9H15NO2/c1-12-8(11)9-4-2-6-10(9)7-3-5-9/h2-7H2,1H3
InChI Key:
HBZKVVLPFLBBNV-UHFFFAOYSA-N
SMILES:
COC(=O)C12CCCN2CCC1
NSC Number:
697383
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.11g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
169.224g/mol
Monoisotopic Mass:
169.11g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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