Name: Name:2-methyl-7-(trifluoromethyl)-1,4-oxazepane, Mixture of diastereomers
Brand: Angene
SKU: AG01BTPV
Rating: 90 (10 reviews)

2-methyl-7-(trifluoromethyl)-1,4-oxazepane, Mixture of diastereomers

CAS No.:

2090998-14-2

Catalog Number:

AG01BTPV

Molecular Formula:

C7H12F3NO

Molecular Weight:

183.1715

Catalog Number:

AG01BTPV

Chemical Name:

2-methyl-7-(trifluoromethyl)-1,4-oxazepane, Mixture of diastereomers

CAS Number:

2090998-14-2

Molecular Formula:

C7H12F3NO

Molecular Weight:

183.1715

MDL Number:

MFCD30730693

IUPAC Name:

2-methyl-7-(trifluoromethyl)-1,4-oxazepane

InChI:

InChI=1S/C7H12F3NO/c1-5-4-11-3-2-6(12-5)7(8,9)10/h5-6,11H,2-4H2,1H3

InChI Key:

OPZMNTLJZPVLJS-UHFFFAOYSA-N

SMILES:

CC1CNCCC(O1)C(F)(F)F

Complexity:

148

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

183.087g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

183.174g/mol

Monoisotopic Mass:

183.087g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

21.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.4