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Home Nitros (1-Benzyl-4-nitromethyl-piperidin-4-yl)-acetic acid ethyl ester

(1-Benzyl-4-nitromethyl-piperidin-4-yl)-acetic acid ethyl ester

CAS No.:
154495-66-6
Catalog Number:
AG00HY8U
Molecular Formula:
C17H24N2O4
Molecular Weight:
320.3835
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$177
- +
250mg
95%
In Stock USA
United States
$331
- +
1g
95%
In Stock USA
United States
$662
- +
5g
95%
In Stock USA
United States
$1985
- +
Product Description
Catalog Number:
AG00HY8U
Chemical Name:
(1-Benzyl-4-nitromethyl-piperidin-4-yl)-acetic acid ethyl ester
CAS Number:
154495-66-6
Molecular Formula:
C17H24N2O4
Molecular Weight:
320.3835
MDL Number:
MFCD21362328
IUPAC Name:
ethyl 2-[1-benzyl-4-(nitromethyl)piperidin-4-yl]acetate
InChI:
InChI=1S/C17H24N2O4/c1-2-23-16(20)12-17(14-19(21)22)8-10-18(11-9-17)13-15-6-4-3-5-7-15/h3-7H,2,8-14H2,1H3
InChI Key:
HQJUZODKTPHDAG-UHFFFAOYSA-N
SMILES:
CCOC(=O)CC1(CCN(CC1)Cc1ccccc1)C[N+](=O)[O-]
Properties
Complexity:
394  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
320.174g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
320.389g/mol
Monoisotopic Mass:
320.174g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
75.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties