Name: Name:methyl 2,2-dimethyl-3-(propan-2-ylsulfanyl)propanoate
Brand: Angene
SKU: AG01B1IB
Rating: 90 (10 reviews)

methyl 2,2-dimethyl-3-(propan-2-ylsulfanyl)propanoate

CAS No.:

1540259-00-4

Catalog Number:

AG01B1IB

Molecular Formula:

C9H18O2S

Molecular Weight:

190.3030

Catalog Number:

AG01B1IB

Chemical Name:

methyl 2,2-dimethyl-3-(propan-2-ylsulfanyl)propanoate

CAS Number:

1540259-00-4

Molecular Formula:

C9H18O2S

Molecular Weight:

190.3030

MDL Number:

MFCD23731792

IUPAC Name:

methyl 2,2-dimethyl-3-propan-2-ylsulfanylpropanoate

InChI:

InChI=1S/C9H18O2S/c1-7(2)12-6-9(3,4)8(10)11-5/h7H,6H2,1-5H3

InChI Key:

CIDFJFXOTLKTFI-UHFFFAOYSA-N

SMILES:

COC(=O)C(CSC(C)C)(C)C

Complexity:

153

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

190.103g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

190.301g/mol

Monoisotopic Mass:

190.103g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

51.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.4