BP Fluor 350 Alkyne

CAT: 0127-BIPG2234-01Size: 1 mgDry Ice: NoHazardous: No

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CAT#:0127-BIPG2234-01Size:1 mg

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

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CAS Number

1239204-75-1

Purity

≥95%

Smiles

CC1=C (C (=O) OC2=CC (=C (C=C12) S (=O) (=O) O) N) CC (=O) NCC#C

Chemical Information

7-Amino-4-methyl-2-oxo-3-(2-oxo-2-(prop-2-YN-1-ylamino)ethyl)-2H-chromene-6-sulfonic acid

CAS Number	1239204-75-1
PubChem CID	44255319
IUPAC Name	7-amino-4-methyl-2-oxo-3-[2-oxo-2-(prop-2-ynylamino)ethyl]chromene-6-sulfonic acid
Molecular Formula	C15H14N2O6S
Molecular Weight	350.3
XLogP	-0.2
Topological Polar Surface Area	144
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	4
Heavy Atom Count	24
Formal Charge	0
Complexity	727

SMILES

CC1=C(C(=O)OC2=CC(=C(C=C12)S(=O)(=O)O)N)CC(=O)NCC#C

InChI

InChI=1S/C15H14N2O6S/c1-3-4-17-14(18)6-10-8(2)9-5-13(24(20,21)22)11(16)7-12(9)23-15(10)19/h1,5,7H,4,6,16H2,2H3,(H,17,18)(H,20,21,22)

InChIKey

WAFXLOCAPUXHFC-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1239204-75-1

CID: 44255319

Formula: C15H14N2O6S

MW: 350.3

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	350.3
XLogP3	-0.2
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	4
Exact Mass	350.05725734
Monoisotopic Mass	350.05725734
Topological Polar Surface Area	144 Å²
Heavy Atom Count	24
Formal Charge	0
Complexity	727
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

Catalog	Name
2255-AAT	Tide Fluor™ 3 alkyne [TF3 alkyne]
2237-AAT	Tide Fluor™ 1 alkyne [TF1 alkyne]
sc-460826	Tide Fluor™ 4 alkyne [TF4 alkyne]
sc-460821	Tide Fluor™ 2 alkyne [TF2 alkyne]
sc-460824	Tide Fluor™ 5 alkyne [TF5 alkyne]
sc-460830	Tide Fluor™ 7 alkyne [TF7 alkyne]
sc-460833	Tide Fluor™ 8 alkyne [TF8 alkyne]
sc-460828	Tide Fluor™ 6 alkyne [TF6 alkyne]
2305-AAT	Tide Fluor™ 7WS alkyne [TF7WS alkyne]
2303-AAT	Tide Fluor™ 6WS alkyne [TF6WS alkyne]