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Home > Amines > 1384264-13-4

1384264-13-4

1384264-13-4 | 3-Oxetaneacetic acid, α-amino-, methyl ester, hydrochloride (1:1)

CAS No: 1384264-13-4 Catalog No: AG00194O MDL No:

Product Description

Catalog Number:
AG00194O
Chemical Name:
3-Oxetaneacetic acid, α-amino-, methyl ester, hydrochloride (1:1)
CAS Number:
1384264-13-4
Molecular Formula:
C6H12ClNO3
Molecular Weight:
181.6174
IUPAC Name:
methyl 2-amino-2-(oxetan-3-yl)acetate;hydrochloride
InChI:
InChI=1S/C6H11NO3.ClH/c1-9-6(8)5(7)4-2-10-3-4;/h4-5H,2-3,7H2,1H3;1H
InChI Key:
FZOASUHNNJEQRM-UHFFFAOYSA-N
SMILES:
COC(=O)C(C1COC1)N.Cl

Properties

Complexity:
133  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.051g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
181.616g/mol
Monoisotopic Mass:
181.051g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
61.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0

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