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132-89-8 | 4H-1,3-Benzoxazin-4-one, 2-(2-chloroethyl)-2,3-dihydro-
CAS No: 132-89-8 Catalog No: AG00102D MDL No:MFCD00012095
Product Description
Catalog Number:
AG00102D
Chemical Name:
4H-1,3-Benzoxazin-4-one, 2-(2-chloroethyl)-2,3-dihydro-
CAS Number:
132-89-8
Molecular Formula:
C10H10ClNO2
Molecular Weight:
211.6449
MDL Number:
MFCD00012095
IUPAC Name:
2-(2-chloroethyl)-2,3-dihydro-1,3-benzoxazin-4-one
InChI:
InChI=1S/C10H10ClNO2/c11-6-5-9-12-10(13)7-3-1-2-4-8(7)14-9/h1-4,9H,5-6H2,(H,12,13)
InChI Key:
YEKMWXFHPZBZLR-UHFFFAOYSA-N
SMILES:
ClCCC1NC(=O)c2c(O1)cccc2
EC Number:
205-082-3
NSC Number:
525254
Properties
Complexity:
222
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.04g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
211.645g/mol
Monoisotopic Mass:
211.04g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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