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Sulfamerazine sodium salt

CAT: 0286-S10975-01Size: 100 gDry Ice: NoHazardous: No
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CAT#:0286-S10975-01Size:100 g
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CAS Number
127-58-2
Pictogram
07 - Irritant
UDF Signal Word
Warning
MDL Number
MFCD00068332
Hazard Statement
H302 Harmful if swallowed; H312 Harmful in contact with skin; H315 Causes skin irritation; H319 Causes serious eye irritation; H332 Harmful if inhaled; H335 May cause respiratory irritation.
DOT Name
Not D.O.T.-Regulated
Precautions
P261 Avoid breathing dust/fume/gas/mist/vapors/spray; P280 Wear protective gloves/protective clothing/eye protection/face protection; P301+P312 IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell; P302+P352 IF ON SKIN: wash with plenty of soap and water; P304+P340 IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing; P305+P351+P338 IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing; P332+P313 IF SKIN irritation occurs: Get medical advice/attention.

Chemical Information

Sulfamerazine Sodium

Sulfamerazine sodium is a sulfonamide.

CAS Number127-58-2
PubChem CID15899899
IUPAC Namesodium (4-aminophenyl)sulfonyl-(4-methylpyrimidin-2-yl)azanide
Molecular FormulaC11H11N4NaO2S
Molecular Weight286.29
Topological Polar Surface Area95.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Heavy Atom Count19
Formal Charge0
Complexity365
SMILES
CC1=NC(=NC=C1)[N-]S(=O)(=O)C2=CC=C(C=C2)N.[Na+]
InChI
InChI=1S/C11H11N4O2S.Na/c1-8-6-7-13-11(14-8)15-18(16,17)10-4-2-9(12)3-5-10;/h2-7H,12H2,1H3;/q-1;+1
InChIKey
BSFJGCCAXDCMOX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Sulfamerazine Sodium
CAS: 127-58-2
CID: 15899899
Formula: C11H11N4NaO2S
MW: 286.29
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight286.29
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Exact Mass286.05004106
Monoisotopic Mass286.05004106
Topological Polar Surface Area95.3 Ų
Heavy Atom Count19
Formal Charge0
Complexity365
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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