sales@angenesci.com
Login | Register
logo
Structures Search
Home Nitros (1R,2R)-(-)-2-Amino-1-(4-nitrophenyl)-1,3-propanediol

(1R,2R)-(-)-2-Amino-1-(4-nitrophenyl)-1,3-propanediol

CAS No.:
716-61-0
Catalog Number:
AG005QRY
Molecular Formula:
C9H12N2O4
Molecular Weight:
212.2026
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
97%
In Stock USA
United States
$13
- +
25g
97%
In Stock USA
United States
$32
- +
100g
97%
In Stock USA
United States
$100
- +
500g
97%
In Stock USA
United States
$400
- +
Product Description
Catalog Number:
AG005QRY
Chemical Name:
(1R,2R)-(-)-2-Amino-1-(4-nitrophenyl)-1,3-propanediol
CAS Number:
716-61-0
Molecular Formula:
C9H12N2O4
Molecular Weight:
212.2026
MDL Number:
MFCD00078126
IUPAC Name:
(1R,2R)-2-amino-1-(4-nitrophenyl)propane-1,3-diol
InChI:
InChI=1S/C9H12N2O4/c10-8(5-12)9(13)6-1-3-7(4-2-6)11(14)15/h1-4,8-9,12-13H,5,10H2/t8-,9-/m1/s1
InChI Key:
OCYJXSUPZMNXEN-RKDXNWHRSA-N
SMILES:
OC[C@H]([C@@H](c1ccc(cc1)N(=O)=O)O)N
EC Number:
211-938-7
Properties
Complexity:
211  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
212.08g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
212.205g/mol
Monoisotopic Mass:
212.08g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
112A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7  
Literature
Title Journal
Bile acid amides derived from chiral amino alcohols: novel antimicrobials and antifungals. Bioorganic & medicinal chemistry letters 20040209
Preparation of optically active threo-2-amino-3-hydroxy-3-phenylpropanoic acid (threo-beta-phenylserine) via optical resolution. Chemical & pharmaceutical bulletin 20031201
Properties