Name: Name:tert-butyl N-{2-[(3-bromo-4-methoxyphenyl)methyl]-3-hydroxypropyl}carbamate
Brand: Angene
SKU: AG01C4MS
Rating: 90 (10 reviews)

tert-butyl N-{2-[(3-bromo-4-methoxyphenyl)methyl]-3-hydroxypropyl}carbamate

CAS No.:

1691952-13-2

Catalog Number:

AG01C4MS

Molecular Formula:

C16H24BrNO4

Molecular Weight:

374.2701

Catalog Number:

AG01C4MS

Chemical Name:

tert-butyl N-{2-[(3-bromo-4-methoxyphenyl)methyl]-3-hydroxypropyl}carbamate

CAS Number:

1691952-13-2

Molecular Formula:

C16H24BrNO4

Molecular Weight:

374.2701

MDL Number:

MFCD29763192

IUPAC Name:

tert-butyl N-[2-[(3-bromo-4-methoxyphenyl)methyl]-3-hydroxypropyl]carbamate

InChI:

InChI=1S/C16H24BrNO4/c1-16(2,3)22-15(20)18-9-12(10-19)7-11-5-6-14(21-4)13(17)8-11/h5-6,8,12,19H,7,9-10H2,1-4H3,(H,18,20)

InChI Key:

JLGOHRHRGMWDJI-UHFFFAOYSA-N

SMILES:

OCC(Cc1ccc(c(c1)Br)OC)CNC(=O)OC(C)(C)C

Complexity:

346

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

373.089g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

374.275g/mol

Monoisotopic Mass:

373.089g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

67.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.1