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1214686-81-3 | 3-Morpholinecarboxylic acid, methyl ester, hydrochloride (1:1)
CAS No: 1214686-81-3 Catalog No: AG00150Q MDL No:MFCD09263285
Product Description
Catalog Number:
AG00150Q
Chemical Name:
3-Morpholinecarboxylic acid, methyl ester, hydrochloride (1:1)
CAS Number:
1214686-81-3
Molecular Formula:
C6H12ClNO3
Molecular Weight:
181.6174
MDL Number:
MFCD09263285
IUPAC Name:
methyl morpholine-3-carboxylate;hydrochloride
InChI:
InChI=1S/C6H11NO3.ClH/c1-9-6(8)5-4-10-3-2-7-5;/h5,7H,2-4H2,1H3;1H
InChI Key:
NSWULSIFJKMWPM-UHFFFAOYSA-N
SMILES:
COC(=O)C1COCCN1.Cl
Properties
Complexity:
126
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:
2
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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