Home Carbonyls 2-(4-(tert-Butoxycarbonyl)-2-methylpiperazin-1-yl)acetic acid

2-(4-(tert-Butoxycarbonyl)-2-methylpiperazin-1-yl)acetic acid

CAS No.:
666853-16-3
Catalog Number:
AG00G1IT
Molecular Formula:
C12H22N2O4
Molecular Weight:
258.3141
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$263
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Product Description
Catalog Number:
AG00G1IT
Chemical Name:
2-(4-(tert-Butoxycarbonyl)-2-methylpiperazin-1-yl)acetic acid
CAS Number:
666853-16-3
Molecular Formula:
C12H22N2O4
Molecular Weight:
258.3141
MDL Number:
MFCD10698347
IUPAC Name:
2-[2-methyl-4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]acetic acid
InChI:
InChI=1S/C12H22N2O4/c1-9-7-14(11(17)18-12(2,3)4)6-5-13(9)8-10(15)16/h9H,5-8H2,1-4H3,(H,15,16)
InChI Key:
DTPBLKDYIFKPAT-UHFFFAOYSA-N
SMILES:
OC(=O)CN1CCN(CC1C)C(=O)OC(C)(C)C
Properties
Complexity:
325  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.158g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
258.318g/mol
Monoisotopic Mass:
258.158g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
70.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.3  
Properties