1-Naphthalenemethanesulfonicacid, 2-amino- supplier

Name
2-aminonaphthalene-1-methylsulphonic acid
EINECS 201-587-8
CAS No. 85-09-6
Density 1.476 g/cm³
Solubility
Melting Point
Formula C₁₁H₁₁NO₃S
Boiling Point
Molecular Weight 237.279
Flash Point
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-Amino-1-naphthalenemethanesulfonicacid;
PSA 88.77000
LogP 3.58800

1-Naphthalenemethanesulfonicacid, 2-amino- Specification

This chemical is called 1-Naphthalenemethanesulfonicacid, 2-amino-, and its systematic name is (2-aminonaphthalen-1-yl)methanesulfonic acid. With the molecular formula of C₁₁H₁₁NO₃S, its molecular weight is 239.29. The CAS registry number of this chemical is 85-09-6.

Other characteristics of the 1-Naphthalenemethanesulfonic acid, 2-amino- can be summarised as followings: (1)ACD/LogP: -0.17; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -3.39; (4)ACD/LogD (pH 7.4): -3.66; (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: 4; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 54.99 Å²; (13)Index of Refraction: 1.711; (14)Molar Refractivity: 62.9 cm³; (15)Molar Volume: 160.6 cm³; (16)Polarizability: 24.93×10^-24cm³; (17)Surface Tension: 75.5 dyne/cm; (18)Density: 1.476 g/cm³.

You can still convert the following datas into molecular structure:
1.SMILES: O=S(=O)(O)Cc1c2c(ccc1N)cccc2
2.InChI: InChI=1/C11H11NO3S/c12-11-6-5-8-3-1-2-4-9(8)10(11)7-16(13,14)15/h1-6H,7,12H2,(H,13,14,15)
3.InChIKey: HAODCXVRFDVUMY-UHFFFAOYAD

Product Name

2-aminonaphthalene-1-methylsulphonic acid

1-Naphthalenemethanesulfonicacid, 2-amino- Specification

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