CS-1140722

3-((Pyrimidin-2-ylthio)methyl)benzoic acid

Manufacturer: ChemScene

CAS Number: 194479-20-4

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Purity

98%

MDL No

None

Storage

Sealed in dry,2-8℃

Shipping

Room temperature in continental US; may vary elsewhere.

Molecular Formula

C₁₂H₁₀N₂O₂S

Molecular Weight

246.28

Synonyms

None

SMILES

O=C(O)C1=CC=CC(=C1)CSC2=NC=CC=N2

Tpsa

63.08

Logp

2.4671

H Acceptors

4

H Donors

1

Rotatable Bonds

4

SAFETY INFORMATION

Pictograms

GHS07

Signal Word

Warning

UN Number

N/A

Class

N/A

Packing Group

N/A

Hazard Statements

H302-H315-H319-H335

Precautionary Statements

P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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ChemScene

CS-1140722

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Purity:
98%

MDL No:
None

Storage:
Sealed in dry,2-8℃

Shipping:
Room temperature in continental US; may vary elsewhere.

Molecular Formula:
C₁₂H₁₀N₂O₂S

Molecular Weight:
246.28

Synonyms:
None

SMILES:
O=C(O)C1=CC=CC(=C1)CSC2=NC=CC=N2

Tpsa:
63.08

Logp:
2.4671

H Acceptors:
4

H Donors:
1

Rotatable Bonds:
4

Img

ChemScene

CS-1140723

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Purity:
98%

MDL No:
None

Storage:
Sealed in dry,2-8℃

Shipping:
Room temperature in continental US; may vary elsewhere.

Molecular Formula:
C₁₀H₁₁BN₂O₃

Molecular Weight:
218.02

Synonyms:
None

SMILES:
O=C1C=2C=CC(=CC2N=C(N1C)C)B(O)O

Tpsa:
75.35

Logp:
-1.07828

H Acceptors:
5

H Donors:
2

Rotatable Bonds:
1

Img

ChemScene

CS-1140724

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Purity:
97%

MDL No:
None

Storage:
Sealed in dry,2-8℃

Shipping:
Room temperature in continental US; may vary elsewhere.

Molecular Formula:
C₈H₈F₃N₃O₂

Molecular Weight:
235.17

Synonyms:
None

SMILES:
O=N(=O)C1=CN=C(C(=C1)C(F)(F)F)N(C)C

Tpsa:
59.27

Logp:
2.0746

H Acceptors:
4

H Donors:
0

Rotatable Bonds:
2

Img

ChemScene

CS-1140726

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Purity:
98%

MDL No:
None

Storage:
Sealed in dry,2-8℃

Shipping:
Room temperature in continental US; may vary elsewhere.

Molecular Formula:
C₉H₁₀N₂O₂

Molecular Weight:
178.19

Synonyms:
None

SMILES:
O=C1NC2=CC=C(OC)C=C2CN1

Tpsa:
50.36

Logp:
1.3303

H Acceptors:
2

H Donors:
2

Rotatable Bonds:
1