CS-0883742

2-(Cyanomethyl)-5-nitrobenzoic acid

Manufacturer: ChemScene

CAS Number: 104825-25-4

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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

C₉H₆N₂O₄

Molecular Weight

206.15

Synonyms

None

SMILES

O=C(O)C1=CC([N+]([O-])=O)=CC=C1CC#N

Tpsa

104.23

Logp

1.35908

H Acceptors

4

H Donors

1

Rotatable Bonds

3

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SAFETY INFORMATION

Pictograms

GHS07

Signal Word

Warning

UN Number

N/A

Class

N/A

Packing Group

N/A

Hazard Statements

H302-H312-H332

Precautionary Statements

P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P363-P501

Compare Similar Items

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Img

ChemScene

CS-0883742

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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:
C₉H₆N₂O₄

Molecular Weight:
206.15

Synonyms:
None

SMILES:
O=C(O)C1=CC([N+]([O-])=O)=CC=C1CC#N

Tpsa:
104.23

Logp:
1.35908

H Acceptors:
4

H Donors:
1

Rotatable Bonds:
3

Img

ChemScene

CS-0883743

--


Purity:
98%

MDL No:
None

Storage:
Sealed in dry,2-8℃

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

Molecular Formula:
C₉H₆ClNO₂

Molecular Weight:
195.60

Synonyms:
None

SMILES:
O=C(O)C1=CC=C(CC#N)C=C1Cl

Tpsa:
61.09

Logp:
2.10428

H Acceptors:
2

H Donors:
1

Rotatable Bonds:
2

Img

ChemScene

CS-0883744

--


Purity:
98%

MDL No:
None

Storage:
Sealed in dry,2-8℃

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

Molecular Formula:
C₉H₆FNO₂

Molecular Weight:
179.15

Synonyms:
None

SMILES:
O=C(O)C1=CC=C(CC#N)C=C1F

Tpsa:
61.09

Logp:
1.58998

H Acceptors:
2

H Donors:
1

Rotatable Bonds:
2

Img

ChemScene

CS-0883745

--


Purity:
98%

MDL No:
None

Storage:
Sealed in dry,2-8℃

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

Molecular Formula:
C₉H₅F₂NO₂

Molecular Weight:
197.14

Synonyms:
None

SMILES:
O=C(O)C1=CC=C(CC#N)C(F)=C1F

Tpsa:
61.09

Logp:
1.72908

H Acceptors:
2

H Donors:
1

Rotatable Bonds:
2