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873697-75-7 | Methyl piperazine-1-carboxylate hydrochloride
CAS No: 873697-75-7 Catalog No: AG00368F MDL No:MFCD12912837
Product Description
Catalog Number:
AG00368F
Chemical Name:
Methyl piperazine-1-carboxylate hydrochloride
CAS Number:
873697-75-7
Molecular Formula:
C6H13ClN2O2
Molecular Weight:
180.6326
MDL Number:
MFCD12912837
IUPAC Name:
methyl piperazine-1-carboxylate;hydrochloride
InChI:
InChI=1S/C6H12N2O2.ClH/c1-10-6(9)8-4-2-7-3-5-8;/h7H,2-5H2,1H3;1H
InChI Key:
RTMYJZVBCVZCCW-UHFFFAOYSA-N
SMILES:
COC(=O)N1CCNCC1.Cl
Properties
Complexity:
121
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.067g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
180.632g/mol
Monoisotopic Mass:
180.067g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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