CAS 7152-03-6 | Cyclopropyl(4-methoxyphenyl);methanone | CAS Number 7152-03-6

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7152-03-6 | Cyclopropyl(4-methoxyphenyl);methanone

CAS No: 7152-03-6 Catalog No: AG003P70 MDL No:MFCD00001296

Product Description

Catalog Number:

AG003P70

Chemical Name:

Cyclopropyl(4-methoxyphenyl);methanone

CAS Number:

7152-03-6

Molecular Formula:

C11H12O2

Molecular Weight:

176.2118

MDL Number:

MFCD00001296

IUPAC Name:

cyclopropyl-(4-methoxyphenyl)methanone

InChI:

InChI=1S/C11H12O2/c1-13-10-6-4-9(5-7-10)11(12)8-2-3-8/h4-8H,2-3H2,1H3

InChI Key:

YKZSVEVTRUSPOQ-UHFFFAOYSA-N

SMILES:

COc1ccc(cc1)C(=O)C1CC1

EC Number:

230-487-7

UNII:

B2980CXL3R

NSC Number:

71980

Properties

Complexity:

188

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

176.084g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

176.215g/mol

Monoisotopic Mass:

176.084g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

26.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.2

Literature

Title	Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa.	Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Non-peptidic small-molecule inhibitors of the single-chain hepatitis C virus NS3 protease/NS4A cofactor complex discovered by structure-based NMR screening.	Journal of medicinal chemistry 20040506