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204252-84-6

204252-84-6 | Carbamic chloride, [(1S)-1-phenylethyl]- (9CI)

CAS No: 204252-84-6 Catalog No: AG0029DB MDL No:

Product Description

Catalog Number:
AG0029DB
Chemical Name:
Carbamic chloride, [(1S)-1-phenylethyl]- (9CI)
CAS Number:
204252-84-6
Molecular Formula:
C9H10ClNO
Molecular Weight:
183.6348
IUPAC Name:
N-[(1S)-1-phenylethyl]carbamoyl chloride
InChI:
InChI=1S/C9H10ClNO/c1-7(11-9(10)12)8-5-3-2-4-6-8/h2-7H,1H3,(H,11,12)/t7-/m0/s1
InChI Key:
JJTGCPHYMITECK-ZETCQYMHSA-N
SMILES:
C[C@@H](c1ccccc1)NC(=O)Cl

Properties

Complexity:
155  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
183.045g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
183.635g/mol
Monoisotopic Mass:
183.045g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  

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