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CAS 112101-77-6 manufacturers and suppliers on PharmaCompass

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CAS 112101-77-6
Also known as: 112101-77-6, (s)-3-(4'-methoxy-3'-sulfonamidophenyl)-2-propylamine hydrochloride, (s)-3-(4 inverted exclamation mark -methoxy-3 inverted exclamation mark -sulfonamidophenyl)-2-propylamine hydrochloride
Molecular Formula
C10H17ClN2O3S
Molecular Weight
280.77  g/mol
InChI Key
KYRRNJIOCLALJQ-FJXQXJEOSA-N

1 2D Structure

CAS 112101-77-6

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
5-[(2S)-2-aminopropyl]-2-methoxybenzenesulfonamide;hydrochloride
2.1.2 InChI
InChI=1S/C10H16N2O3S.ClH/c1-7(11)5-8-3-4-9(15-2)10(6-8)16(12,13)14;/h3-4,6-7H,5,11H2,1-2H3,(H2,12,13,14);1H/t7-;/m0./s1
2.1.3 InChI Key
KYRRNJIOCLALJQ-FJXQXJEOSA-N
2.1.4 Canonical SMILES
CC(CC1=CC(=C(C=C1)OC)S(=O)(=O)N)N.Cl
2.1.5 Isomeric SMILES
C[C@@H](CC1=CC(=C(C=C1)OC)S(=O)(=O)N)N.Cl
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 112101-77-6

2. (s)-3-(4'-methoxy-3'-sulfonamidophenyl)-2-propylamine Hydrochloride

3. (s)-3-(4 Inverted Exclamation Mark -methoxy-3 Inverted Exclamation Mark -sulfonamidophenyl)-2-propylamine Hydrochloride

2.3 Create Date
2007-02-08
3 Chemical and Physical Properties
Molecular Weight 280.77 g/mol
Molecular Formula C10H17ClN2O3S
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass280.0648413 g/mol
Monoisotopic Mass280.0648413 g/mol
Topological Polar Surface Area104 Ų
Heavy Atom Count17
Formal Charge0
Complexity313
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count2
Flag India
Digital Content Digital Content
URL Supplier Web Content
CAS-112101-81-2
Tamsulosin
We are Rampex Labs, a fully cGMP compliant pharmaceutical intermediates plant located in the outskirts of...
We are Rampex Labs, a fully cGMP compliant pharmaceutical intermediates plant located in the outskirts of Hyderabad, India. Our company was founded in 2004 with commercial operations starting initially by outsourcing our production. In January 2008, our own production became operational and our journey really began. From our inception, we have strived to be the best and work with the best. Our client list comprises of some of the leading API producers within India and abroad. We at Rampex strongly believe that commitment to quality and timely deliveries ensure a very smooth working relationship with all our customers.
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