Welcome to LookChem.com Sign In|Join Free
  • or
Home > Products >  > 

Benzoicacid, 3-borono-5-[[(1,1-dimethylethoxy)carbonyl]amino]- (9CI)

Related Products

Hot Products

Basic Information Post buying leads Suppliers
Name

Benzoicacid, 3-borono-5-[[(1,1-dimethylethoxy)carbonyl]amino]- (9CI)

EINECS N/A
CAS No. 913835-72-0 Density 1.33 g/cm3
PSA 116.09000 LogP 0.48460
Solubility N/A Melting Point >300°C
Formula C12H16BNO6 Boiling Point N/A
Molecular Weight 281.06954 Flash Point N/A
Transport Information N/A Appearance N/A
Safety 36/37 Risk Codes 43
Molecular Structure Molecular Structure of 913835-72-0 (3-AMINO-5-CARBOXYBENZENEBORONIC ACID, N-BOC PROTECTED 98) Hazard Symbols IrritantXi
Synonyms

3-AMINO-5-CARBOXYBENZENEBORONIC ACID, N-BOC PROTECTED 98;3-BORONO-5-(TERT-BUTOXYCARBONYLAMINO)BENZOIC ACID;3-AMINO-5-CARBOXYBENZENEBORONIC ACID, N-BOC PROTECTED;3-(N-BOC-AMINO)-5-CARBOXYPHENYLBORONIC ACID;3-Amino-5-carboxybenzeneboronic acid, N-BOC protected 98%;3-(Boc-aMino)-5-carboxybenzeneboronic acid, 98%

 

Benzoicacid, 3-borono-5-[[(1,1-dimethylethoxy)carbonyl]amino]- (9CI) Specification

The Benzoicacid, 3-borono-5-[[(1,1-dimethylethoxy)carbonyl]amino]- (9CI), with CAS registry number 913835-72-0, belongs to the following product categories: (1)Blocks; (2)Boronic Acids. It has the systematic name of 3-borono-5-(tert-butoxycarbonylamino)benzoic acid. This chemical should be kept cold. And the chemical formula of this chemical is C12H16BNO6.

Physical properties of Benzoicacid, 3-borono-5-[[(1,1-dimethylethoxy)carbonyl]amino]- (9CI): (1)ACD/LogP: 2.39; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.51; (4)#H bond acceptors: 7; (5)#H bond donors: 4; (6)#Freely Rotating Bonds: 7; (7)Polar Surface Area: 116.09 Å2; (8)Index of Refraction: 1.561; (9)Molar Refractivity: 68.22 cm3; (10)Molar Volume: 210.5 cm3; (11)Polarizability: 27.04×10-24cm3; (12)Surface Tension: 57.8 dyne/cm; (13)Density: 1.33 g/cm3.

You can still convert the following datas into molecular structure:
(1)SMILES: B(c1cc(cc(c1)NC(=O)OC(C)(C)C)C(=O)O)(O)O
(2)InChI: InChI=1/C12H16BNO6/c1-12(2,3)20-11(17)14-9-5-7(10(15)16)4-8(6-9)13(18)19/h4-6,18-19H,1-3H3,(H,14,17)(H,15,16)
(3)InChIKey: DDZVPNHBJRCXEI-UHFFFAOYAE
(4)Std. InChI: InChI=1S/C12H16BNO6/c1-12(2,3)20-11(17)14-9-5-7(10(15)16)4-8(6-9)13(18)19/h4-6,18-19H,1-3H3,(H,14,17)(H,15,16)
(5)Std. InChIKey: DDZVPNHBJRCXEI-UHFFFAOYSA-N

Post a RFQ

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

1

What can I do for you?
Get Best Price

Get Best Price for 913835-72-0