Chem 2 Amino 2 Phenyl Butyric Acid Bcipl

Compound 61
  CheckMol                        TMF02:r0:m0
MF=C10H13NO2 MW=179.22
 13 13  0  1  0               999 V2000
    0.0000   -0.0000   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6463    0.5916   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6592    2.1093   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9582   -0.1415   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9711   -1.6334   -0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6720   -0.8746   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -4.2701    0.6174   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6849   -2.3666   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -0.4630   -0.3344   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -5.5820   -0.1158   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3987   -3.0997   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    0.9003   -0.8489   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    0.8875   -2.3408   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  4  5  1  0  0  0  0
  4  6  1  0  0  0  0
  4  7  1  0  0  0  0
  6  8 02  0  1  0  0
  6  9 01  0  1  0  0
  7 10  1  0  0  0  0
  8 11 01  0  1  0  0
  9 12 02  0  1  0  0
 11 13 02  0  1  0  0
 12 13 01  0  1  0  0
M  END

2-Amino-2-Phenyl Butyric Acid

₹ 0.00 0.00

Chemical Name - 2-Amino-2-Phenyl Butyric Acid
Mol Weight - 179.218
Smiles - CCC(C(O)=O)(c1ccccc1)N
InChI - UBXUDSPYIGPGGP-UHFFFAOYSA-N
InChIKey - InChI=1S/C10H13NO2/c1-2-10(11,9(12)13)8-6-4-3-5-7-8/h3-7H,2,11H2,1H3,(H,12,13)

Property Name	Property Value
Mol Name	2-Amino-2-Phenyl Butyric Acid
Molweight	179.218
Monoisotopic Mass	179.094629
Clogp	-1.011
Clogs	-1.806
H Acceptors	3
H Donors	2
Total Surface Area	142.31
Relative Psa	0.29098
Polar Surface Area	63.32
Druglikeness	-2.7425
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Shape Index	0.53846
Molecular Flexibility	0.66391
Molecular Complexity	0.66172
Fragments	1
Non H Atoms	13
Non Ch Atoms	3
Electronegative Atoms	3
Stereo Centers	1
Rotatable Bonds	3
Rings Closures	1
Small Rings	1
Aromatic Rings	1
Aromatic Atoms	6
Sp3 Atoms	5
Symmetric Atoms	2
Amines	1
Alkyl Amines	1
Basic Nitrogens	1
Acidic Oxygens	1
Smiles	CCC(C(O)=O)(c1ccccc1)N
InChIKey	InChI=1S/C10H13NO2/c1-2-10(11,9(12)13)8-6-4-3-5-7-8/h3-7H,2,11H2,1H3,(H,12,13)
InChI	UBXUDSPYIGPGGP-UHFFFAOYSA-N

Copyrights

The copyrights of data, design, and listing all reserved to Global Manufacturers and its associated sites.

Company profile , trade leads and products are user generated content.

Molecule Properties are generated theoretically any objection please contact us

Shipping

Usually delivered in 3-4 days

Enter pincode for exact delivery dates/charges

Credit / Debit Card Payment

We accept all major credit / debit card for payment, you can also pay through online banking.

Cash On Delivery

If Available. Select Cash on Delivery (CoD) payment option while placing the order and later, pay in cash at the time of actual delivery of product. No advance payment needed.

Click to Load Molecule
1 - 2-Amino-2-Phenyl Butyric Acid
2 - 2-Amino-2-Phenyl Butyric Acid

Chemryt - We contribute to the Chemicals, Pharmaceutical & Biotech industry using information technology

2-Amino-2-Phenyl Butyric Acid