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724773-04-0 | Spiro[2.4]heptane-1-carboxylicacid, 1-(aminomethyl)-5,6-dimethyl-
CAS No: 724773-04-0 Catalog No: AG005HF0 MDL No:
Product Description
Catalog Number:
AG005HF0
Chemical Name:
Spiro[2.4]heptane-1-carboxylicacid, 1-(aminomethyl)-5,6-dimethyl-
CAS Number:
724773-04-0
Molecular Formula:
C11H19NO2
Molecular Weight:
197.2741
IUPAC Name:
2-(aminomethyl)-5,6-dimethylspiro[2.4]heptane-2-carboxylic acid
InChI:
InChI=1S/C11H19NO2/c1-7-3-10(4-8(7)2)5-11(10,6-12)9(13)14/h7-8H,3-6,12H2,1-2H3,(H,13,14)
InChI Key:
HRLADBRXOPGTFN-UHFFFAOYSA-N
SMILES:
NCC1(CC21CC(C(C2)C)C)C(=O)O
Properties
Complexity:
267
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.142g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
197.278g/mol
Monoisotopic Mass:
197.142g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.9
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