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1808249-67-3 | Spiro[3.3]heptane-2-carboxylic acid, 6-amino-, methyl ester, hydrochloride (1:1)
CAS No: 1808249-67-3 Catalog No: AG0022D2 MDL No:MFCD11099890
Product Description
Catalog Number:
AG0022D2
Chemical Name:
Spiro[3.3]heptane-2-carboxylic acid, 6-amino-, methyl ester, hydrochloride (1:1)
CAS Number:
1808249-67-3
Molecular Formula:
C9H16ClNO2
Molecular Weight:
205.6818
MDL Number:
MFCD11099890
IUPAC Name:
methyl 2-aminospiro[3.3]heptane-6-carboxylate;hydrochloride
InChI:
InChI=1S/C9H15NO2.ClH/c1-12-8(11)6-2-9(3-6)4-7(10)5-9;/h6-7H,2-5,10H2,1H3;1H
InChI Key:
YPGLGGXSCLUQOR-UHFFFAOYSA-N
SMILES:
COC(=O)C1CC2(C1)CC(C2)N.Cl
Properties
Complexity:
201
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:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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