Name: Name:5-methyl-1-[2-(oxan-2-yloxy)ethyl]-1H-pyrazole-4-carboxylic acid
Brand: Angene
SKU: AG01A2Z4
Rating: 90 (10 reviews)

5-methyl-1-[2-(oxan-2-yloxy)ethyl]-1H-pyrazole-4-carboxylic acid

CAS No.:

1423028-01-6

Catalog Number:

AG01A2Z4

Molecular Formula:

C12H18N2O4

Molecular Weight:

254.2823

Catalog Number:

AG01A2Z4

Chemical Name:

5-methyl-1-[2-(oxan-2-yloxy)ethyl]-1H-pyrazole-4-carboxylic acid

CAS Number:

1423028-01-6

Molecular Formula:

C12H18N2O4

Molecular Weight:

254.2823

MDL Number:

MFCD22628427

IUPAC Name:

5-methyl-1-[2-(oxan-2-yloxy)ethyl]pyrazole-4-carboxylic acid

InChI:

InChI=1S/C12H18N2O4/c1-9-10(12(15)16)8-13-14(9)5-7-18-11-4-2-3-6-17-11/h8,11H,2-7H2,1H3,(H,15,16)

InChI Key:

AAXWPWINDWOHQI-UHFFFAOYSA-N

SMILES:

OC(=O)c1cnn(c1C)CCOC1CCCCO1

Complexity:

287

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

254.127g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

254.286g/mol

Monoisotopic Mass:

254.127g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

73.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.8