Amicarbalide supplier | CasNO.3459-96-9

Name
Amicarbalide
EINECS 222-402-7
CAS No. 3459-96-9
Density 1.4 g/cm³
Solubility
Melting Point
Formula C₁₅H₁₆N₆O
Boiling Point
Molecular Weight 296.332
Flash Point
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Carbanilide,3,3'-diamidino- (7CI,8CI);3,3'-Diamidinocarbanilide;Amicarbalide;3,3'-Ureylenebisbenzamidine;
PSA 140.87000
LogP 3.64480

Amicarbalide Specification

The CAS register number of Benzenecarboximidamide,3,3'-(carbonyldiimino)bis- is 3459-96-9. It also can be called as Amicarbalide and the IUPAC name about this chemical is 1,3-bis(3-carbamimidoylphenyl)urea. The molecular formula about this chemical is C₁₅H₁₆N₆O and the molecular weight is 296.332.

Physical properties about Benzenecarboximidamide,3,3'-(carbonyldiimino)bis- are: (1)ACD/LogP: 0.42; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): -2.58; (4)ACD/LogD (pH 7.4): -2.58; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 7; (10)#H bond donors: 8; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 54.75 Å²; (13)Index of Refraction: 1.696; (14)Molar Refractivity: 81.19 cm³; (15)Molar Volume: 210.8 cm³; (16)Polarizability: 32.18x10^-24cm³; (17)Surface Tension: 64.5 dyne/cm; (18)Density: 1.4 g/cm³.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(Nc1cc(ccc1)C(=[N@H])N)Nc2cc(C(=[N@H])N)ccc2
(2)InChI: InChI=1/C15H16N6O/c16-13(17)9-3-1-5-11(7-9)20-15(22)21-12-6-2-4-10(8-12)14(18)19/h1-8H,(H3,16,17)(H3,18,19)(H2,20,21,22)
(3)InChIKey: KRUVSRGJKCHYMY-UHFFFAOYAQ
(4)Std. InChI: InChI=1S/C15H16N6O/c16-13(17)9-3-1-5-11(7-9)20-15(22)21-12-6-2-4-10(8-12)14(18)19/h1-8H,(H3,16,17)(H3,18,19)(H2,20,21,22)
(5)Std. InChIKey: KRUVSRGJKCHYMY-UHFFFAOYSA-N

Product Name

Amicarbalide

Amicarbalide Specification

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