Name: Name:4-[3-(aminomethyl)pentan-3-yl]-1,2-dichlorobenzene
Brand: Angene
SKU: AG01AAKO
Rating: 90 (10 reviews)

4-[3-(aminomethyl)pentan-3-yl]-1,2-dichlorobenzene

CAS No.:

1183596-21-5

Catalog Number:

AG01AAKO

Molecular Formula:

C12H17Cl2N

Molecular Weight:

246.1761

Catalog Number:

AG01AAKO

Chemical Name:

4-[3-(aminomethyl)pentan-3-yl]-1,2-dichlorobenzene

CAS Number:

1183596-21-5

Molecular Formula:

C12H17Cl2N

Molecular Weight:

246.1761

MDL Number:

MFCD12816650

IUPAC Name:

2-(3,4-dichlorophenyl)-2-ethylbutan-1-amine

InChI:

InChI=1S/C12H17Cl2N/c1-3-12(4-2,8-15)9-5-6-10(13)11(14)7-9/h5-7H,3-4,8,15H2,1-2H3

InChI Key:

JZTBHJVBWOYXCN-UHFFFAOYSA-N

SMILES:

CCC(c1ccc(c(c1)Cl)Cl)(CN)CC

Complexity:

192

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

245.074g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

246.175g/mol

Monoisotopic Mass:

245.074g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

26A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.1