Home Carboxys 4-Trans-[(boc)2-guanidino]cyclohexane carboxylic acid

4-Trans-[(boc)2-guanidino]cyclohexane carboxylic acid

CAS No.:
1263046-44-1
Catalog Number:
AG00VQ6S
Molecular Formula:
C18H31N3O6
Molecular Weight:
385.4552
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
≥ 99% (HPLC)
1 week
United States
$111
- +
1g
≥ 99% (HPLC)
1 week
United States
$272
- +
5g
≥ 99% (HPLC)
1 week
United States
$886
- +
Product Description
Catalog Number:
AG00VQ6S
Chemical Name:
4-Trans-[(boc)2-guanidino]cyclohexane carboxylic acid
CAS Number:
1263046-44-1
Molecular Formula:
C18H31N3O6
Molecular Weight:
385.4552
MDL Number:
MFCD18426559
IUPAC Name:
4-[bis[(2-methylpropan-2-yl)oxycarbonylamino]methylideneamino]cyclohexane-1-carboxylic acid
InChI:
InChI=1S/C18H31N3O6/c1-17(2,3)26-15(24)20-14(21-16(25)27-18(4,5)6)19-12-9-7-11(8-10-12)13(22)23/h11-12H,7-10H2,1-6H3,(H,22,23)(H2,19,20,21,24,25)
InChI Key:
IQUNZZZNJUCWCG-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NC(=N[C@@H]1CC[C@H](CC1)C(=O)O)NC(=O)OC(C)(C)C C18H31N3O6
Properties
Complexity:
549  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
385.221g/mol
Formal Charge:
0
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
385.461g/mol
Monoisotopic Mass:
385.221g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
126A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Properties