Name: Name:(BUTAN-2-YL)[3-(3-CHLOROPHENOXY)-2-HYDROXYPROPYL]AMINE
Brand: Angene
SKU: AG01EMLM
Rating: 90 (10 reviews)

(BUTAN-2-YL)[3-(3-CHLOROPHENOXY)-2-HYDROXYPROPYL]AMINE

CAS No.:

1179633-55-6

Catalog Number:

AG01EMLM

Molecular Formula:

C13H20ClNO2

Molecular Weight:

257.7564

Catalog Number:

AG01EMLM

Chemical Name:

(BUTAN-2-YL)[3-(3-CHLOROPHENOXY)-2-HYDROXYPROPYL]AMINE

CAS Number:

1179633-55-6

Molecular Formula:

C13H20ClNO2

Molecular Weight:

257.7564

MDL Number:

MFCD11924038

IUPAC Name:

1-(butan-2-ylamino)-3-(3-chlorophenoxy)propan-2-ol

InChI:

InChI=1S/C13H20ClNO2/c1-3-10(2)15-8-12(16)9-17-13-6-4-5-11(14)7-13/h4-7,10,12,15-16H,3,8-9H2,1-2H3

InChI Key:

PKOKCYNVYOFKSF-UHFFFAOYSA-N

SMILES:

CCC(NCC(COc1cccc(c1)Cl)O)C

Complexity:

204

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

257.118g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

257.758g/mol

Monoisotopic Mass:

257.118g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

41.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.9