HJC0350 100mg

CAT: 0628-A14266-100Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0628-A14266-100Size:100 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

885434-70-8

Chemical Information

Hjc 0350

CAS Number	885434-70-8
PubChem CID	22200891
IUPAC Name	2,4-dimethyl-1-(2,4,6-trimethylphenyl)sulfonylpyrrole
Molecular Formula	C15H19NO2S
Molecular Weight	277.4
XLogP	3.7
Topological Polar Surface Area	47.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Heavy Atom Count	19
Formal Charge	0
Complexity	402

SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2C=C(C=C2C)C)C

InChI

InChI=1S/C15H19NO2S/c1-10-6-12(3)15(13(4)7-10)19(17,18)16-9-11(2)8-14(16)5/h6-9H,1-5H3

InChIKey

AFZWZVLPIMHLSE-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 885434-70-8

CID: 22200891

Formula: C15H19NO2S

MW: 277.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	277.4
XLogP3	3.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	277.11365002
Monoisotopic Mass	277.11365002
Topological Polar Surface Area	47.5 Å²
Heavy Atom Count	19
Formal Charge	0
Complexity	402
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes