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1807882-36-5 | 3-Morpholinecarboxylic acid, 2-methyl-, hydrochloride (1:1), (2R,3S)-rel-
CAS No: 1807882-36-5 Catalog No: AG0022CF MDL No:MFCD28101670
Product Description
Catalog Number:
AG0022CF
Chemical Name:
3-Morpholinecarboxylic acid, 2-methyl-, hydrochloride (1:1), (2R,3S)-rel-
CAS Number:
1807882-36-5
Molecular Formula:
C6H12ClNO3
Molecular Weight:
181.6174
MDL Number:
MFCD28101670
IUPAC Name:
(2R,3S)-2-methylmorpholine-3-carboxylic acid;hydrochloride
InChI:
InChI=1S/C6H11NO3.ClH/c1-4-5(6(8)9)7-2-3-10-4;/h4-5,7H,2-3H2,1H3,(H,8,9);1H/t4-,5+;/m1./s1
InChI Key:
RHSLKJXCSUYWPS-JBUOLDKXSA-N
SMILES:
OC(=O)[C@H]1NCCO[C@@H]1C.Cl
Properties
Complexity:
137
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
2
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:
3
Isotope Atom Count:
0
Molecular Weight:
181.616g/mol
Monoisotopic Mass:
181.051g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
58.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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