CS-1012096

5-(Methoxycarbonyl)-1-methyl-1H-1,2,4-triazole-3-carboxylic acid

Manufacturer: ChemScene

CAS Number: 2091410-43-2

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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

C₆H₇N₃O₄

Molecular Weight

185.14

Synonyms

None

SMILES

O=C(O)C=1N=C(C(=O)OC)N(N1)C

Tpsa

94.31

Logp

-0.7001

H Acceptors

6

H Donors

1

Rotatable Bonds

2

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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Img

ChemScene

CS-1012096

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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:
C₆H₇N₃O₄

Molecular Weight:
185.14

Synonyms:
None

SMILES:
O=C(O)C=1N=C(C(=O)OC)N(N1)C

Tpsa:
94.31

Logp:
-0.7001

H Acceptors:
6

H Donors:
1

Rotatable Bonds:
2

Img

ChemScene

CS-1012098

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Purity:
95%

MDL No:
None

Storage:
Sealed in dry,2-8℃

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

Molecular Formula:
C₁₄H₁₄N₂O₃

Molecular Weight:
258.27

Synonyms:
None

SMILES:
O=C(OC)C1=NC=NC(=C1OCC=2C=CC=CC2)C

Tpsa:
61.31

Logp:
2.15062

H Acceptors:
5

H Donors:
0

Rotatable Bonds:
4

Img

ChemScene

CS-1012100

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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:
C₉H₆F₃NO₃

Molecular Weight:
233.14

Synonyms:
None

SMILES:
O=CC1=CN=C(C(=O)OC)C(=C1)C(F)(F)F

Tpsa:
56.26

Logp:
1.6995

H Acceptors:
4

H Donors:
0

Rotatable Bonds:
2

Img

ChemScene

CS-1012102

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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:
C₈H₁₁FO

Molecular Weight:
142.17

Synonyms:
None

SMILES:
O=CC12CCC(F)(CC1)C2

Tpsa:
17.07

Logp:
1.8577

H Acceptors:
1

H Donors:
0

Rotatable Bonds:
1