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2230799-76-3 | methyl 4-aminohexanoate hydrochloride
CAS No: 2230799-76-3 Catalog No: AG01FJD5 MDL No:
Product Description
Catalog Number:
AG01FJD5
Chemical Name:
methyl 4-aminohexanoate hydrochloride
CAS Number:
2230799-76-3
Molecular Formula:
C7H16ClNO2
Molecular Weight:
181.6604
IUPAC Name:
methyl 4-aminohexanoate;hydrochloride
InChI:
InChI=1S/C7H15NO2.ClH/c1-3-6(8)4-5-7(9)10-2;/h6H,3-5,8H2,1-2H3;1H
InChI Key:
CRUSHBXZIABOPL-UHFFFAOYSA-N
SMILES:
CCC(CCC(=O)OC)N.Cl
Properties
Complexity:
104
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.087g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
181.66g/mol
Monoisotopic Mass:
181.087g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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