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1233200-48-0 | 3-Piperidineacetic acid, ethyl ester, hydrochloride (1:1), (3R)-
CAS No: 1233200-48-0 Catalog No: AG000KC7 MDL No:MFCD09955432
Product Description
Catalog Number:
AG000KC7
Chemical Name:
3-Piperidineacetic acid, ethyl ester, hydrochloride (1:1), (3R)-
CAS Number:
1233200-48-0
Molecular Formula:
C9H18ClNO2
Molecular Weight:
207.6977
MDL Number:
MFCD09955432
IUPAC Name:
ethyl 2-[(3R)-piperidin-3-yl]acetate;hydrochloride
InChI:
InChI=1S/C9H17NO2.ClH/c1-2-12-9(11)6-8-4-3-5-10-7-8;/h8,10H,2-7H2,1H3;1H/t8-;/m1./s1
InChI Key:
NUFQPPPCFKZWRT-DDWIOCJRSA-N
SMILES:
CCOC(=O)C[C@H]1CCCNC1.Cl
Properties
Complexity:
148
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
207.103g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
207.698g/mol
Monoisotopic Mass:
207.103g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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