CS-0227215

tert-Butyl 4-formyl-3,6-dihydropyridine-1(2H)-carboxylate

Manufacturer: ChemScene

CAS Number: 1780737-34-9

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Purity

97%

MDL No

None

Storage

-20°C, stored under nitrogen

Shipping

Room temperature in continental US; may vary elsewhere.

Molecular Formula

C₁₁H₁₇NO₃

Molecular Weight

211.26

Synonyms

1(2H)-Pyridinecarboxylic acid, 4-formyl-3,6-dihydro-, 1,1-dimethylethyl ester

SMILES

O=C(N1CC=C(C=O)CC1)OC(C)(C)C

Tpsa

46.61

Logp

1.7525

H Acceptors

3

H Donors

0

Rotatable Bonds

1

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-0227215

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Purity:
97%

MDL No:
None

Storage:
-20°C, stored under nitrogen

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

Molecular Formula:
C₁₁H₁₇NO₃

Molecular Weight:
211.26

Synonyms:
1(2H)-Pyridinecarboxylic acid, 4-formyl-3,6-dihydro-, 1,1-dimethylethyl ester

SMILES:
O=C(N1CC=C(C=O)CC1)OC(C)(C)C

Tpsa:
46.61

Logp:
1.7525

H Acceptors:
3

H Donors:
0

Rotatable Bonds:
1

Img

ChemScene

CS-0227217

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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:
C₁₅H₁₆O₂

Molecular Weight:
228.29

Synonyms:
None

SMILES:
OCC1=CC=CC=C1CC2=CC=CC(OC)=C2

Tpsa:
29.46

Logp:
2.7783

H Acceptors:
2

H Donors:
1

Rotatable Bonds:
4

Img

ChemScene

CS-0227219

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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:
C₁₄H₁₃ClO

Molecular Weight:
232.71

Synonyms:
None

SMILES:
OCC1=CC=CC=C1CC2=CC=CC(Cl)=C2

Tpsa:
20.23

Logp:
3.4231

H Acceptors:
1

H Donors:
1

Rotatable Bonds:
3

Img

ChemScene

CS-0227222

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Purity:
97%

MDL No:
MFCD00004627

Storage:
Sealed in dry,2-8℃

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

Molecular Formula:
C₁₄H₁₄O

Molecular Weight:
198.26

Synonyms:
2-Benzylbenzyl alcohol

SMILES:
OCC1=CC=CC=C1CC2=CC=CC=C2

Tpsa:
20.23

Logp:
2.7697

H Acceptors:
1

H Donors:
1

Rotatable Bonds:
3