CS-0577712

3-Amino-4-(4-methylpiperazin-1-yl)benzoic acid trihydrate

Manufacturer: ChemScene

CAS Number: 1185300-77-9

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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

C₁₂H₂₃N₃O₅

Molecular Weight

289.33

Synonyms

3-Amino-4-(4-methyl-piperazin-1-yl)-benzoic acidtrihydrate

SMILES

CN1CCN(CC1)C2=C(C=C(C=C2)C(=O)O)N.O.O.O

Tpsa

164.3

Logp

-1.7553

H Acceptors

4

H Donors

2

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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ChemScene

CS-0577712

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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:
C₁₂H₂₃N₃O₅

Molecular Weight:
289.33

Synonyms:
3-Amino-4-(4-methyl-piperazin-1-yl)-benzoic acidtrihydrate

SMILES:
CN1CCN(CC1)C2=C(C=C(C=C2)C(=O)O)N.O.O.O

Tpsa:
164.3

Logp:
-1.7553

H Acceptors:
4

H Donors:
2

Rotatable Bonds:
2

Img

ChemScene

CS-0577713

--


Purity:
98%

MDL No:
None

Storage:
Sealed in dry,2-8℃

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

Molecular Formula:
C₇H₁₀Cl₃FN₂

Molecular Weight:
247.53

Synonyms:
(2-Chloro-6-fluorobenzyl)hydrazinedihydrochloride

SMILES:
NNCC1=C(F)C=CC=C1Cl.[H]Cl.[H]Cl

Tpsa:
38.05

Logp:
2.286

H Acceptors:
2

H Donors:
2

Rotatable Bonds:
2

Img

ChemScene

CS-0577714

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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:
C₁₃H₉F₄NO₂

Molecular Weight:
287.21

Synonyms:
4-Quinolinecarboxylic acid, 6-fluoro-2-(trifluoromethyl)-, ethyl ester

SMILES:
CCOC(=O)C1=CC(=NC2=C1C=C(C=C2)F)C(F)(F)F

Tpsa:
39.19

Logp:
3.5694

H Acceptors:
3

H Donors:
0

Rotatable Bonds:
2

Img

ChemScene

CS-0577715

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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:
C₈H₇Cl₂N₃S

Molecular Weight:
248.13

Synonyms:
None

SMILES:
C1=CC(=CC=C1C2=C(SN=N2)N)Cl.Cl

Tpsa:
51.8

Logp:
2.8625

H Acceptors:
4

H Donors:
1

Rotatable Bonds:
1