CAS
99473-14-0 Purity
96%
99473-14-0 Purity
96%
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2-chloro-1-(3-nitrophenyl)ethanone
CAS
99-47-8
Catalog Number
ACM99478
Category
Other Products
Molecular Weight
199.591 g/mol
Molecular Formula
C8H6ClNO3
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Specification
Synonyms
USAF MA-8, 2-Chloro-m-nitroacetophenone, Acetophenone, 2-chloro-m-nitro-, alpha-Chloro-m-nitro-acetophenone, BRN 1958853, CID7437, .alpha.-Chloro-m-nitro-acetophenone, ZINC02041163, LS-13438, 3-07-00-00996 (Beilstein Handbook Reference), 99-47-8
IUPAC Name
2-chloro-1-(3-nitrophenyl)ethanone
InChI Key
LBHUVZXFCGZYDL-UHFFFAOYSA-N
Exact Mass
199.00400
H-Bond Acceptor
3
H-Bond Donor
0
What is the molecular formula of 2-chloro-1-(3-nitrophenyl)ethanone?
The molecular formula of 2-chloro-1-(3-nitrophenyl)ethanone is C8H6ClNO3.
What is the molecular weight of 2-chloro-1-(3-nitrophenyl)ethanone?
The molecular weight of 2-chloro-1-(3-nitrophenyl)ethanone is 199.59 g/mol.
What is the IUPAC name of 2-chloro-1-(3-nitrophenyl)ethanone?
The IUPAC name of 2-chloro-1-(3-nitrophenyl)ethanone is 2-chloro-1-(3-nitrophenyl)ethanone.
What is the InChI of 2-chloro-1-(3-nitrophenyl)ethanone?
The InChI of 2-chloro-1-(3-nitrophenyl)ethanone is InChI=1S/C8H6ClNO3/c9-5-8(11)6-2-1-3-7(4-6)10(12)13/h1-4H,5H2.
What is the InChIKey of 2-chloro-1-(3-nitrophenyl)ethanone?
The InChIKey of 2-chloro-1-(3-nitrophenyl)ethanone is LBHUVZXFCGZYDL-UHFFFAOYSA-N.
What is the canonical SMILES of 2-chloro-1-(3-nitrophenyl)ethanone?
The canonical SMILES of 2-chloro-1-(3-nitrophenyl)ethanone is C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)CCl.
What is the CAS number of 2-chloro-1-(3-nitrophenyl)ethanone?
The CAS number of 2-chloro-1-(3-nitrophenyl)ethanone is 99-47-8.
What is the XLogP3 value of 2-chloro-1-(3-nitrophenyl)ethanone?
The XLogP3 value of 2-chloro-1-(3-nitrophenyl)ethanone is 2.
How many hydrogen bond donor counts does 2-chloro-1-(3-nitrophenyl)ethanone have?
2-chloro-1-(3-nitrophenyl)ethanone has 0 hydrogen bond donor counts.
How many rotatable bond counts does 2-chloro-1-(3-nitrophenyl)ethanone have?
2-chloro-1-(3-nitrophenyl)ethanone has 2 rotatable bond counts.
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99479-46-6 Purity
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