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3-bromo-N-phenylbenzamide

HCID 853652
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
63710-33-8
Standard SMILES
O=C(Nc1ccccc1)c1cccc(Br)c1
InChIKey
SAGPZJDZARMYKP-UHFFFAOYSA-N
Molecular formula
C13H10BrNO
Average molar mass
276.13 g/mol
Monoisotopic mass
274.99458

Names & identifiers

Preferred name
3-bromo-N-phenylbenzamide
IUPAC
3-bromo-N-phenylbenzamide
English name
3-Bromo-N-phenylbenzamide
Molecular formula
C13H10BrNO
Molecular weight
276.13

Names & synonyms

3-bromo-N-phenylbenzamide63710-33-8DTXSID60357461RefChem:277727DTXCID70308520MFCD00087947n-phenyl-3-bromobenzamideCHEMBL42922513-BROMOBENZANILIDECBMicro_000493SCHEMBL3827286SMSF0006611
Show more names
Benzamide, 3-bromo-N-phenyl-
BDBM50468069STK155715AKOS000171731CB01707DS-3449SY3170603-bromo-N-phenyl-benzamideBIM-0000353.P001

Database identifiers

CAS
63710-33-8
PubChem CID
853652
DTXSID
DTXSID60357461
ChEMBL
CHEMBL4292251
Nikkaji
J2.516.724D

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
29.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
2
Heavy atoms
16
Formal charge
0
Complexity
238

Physicochemical properties

storage temp.
Sealed in dry,Room Temperature
Appearance
White to off-white Solid
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
315 · H315-H319-H335
Precautionary statements
261 · P261-P305+P351+P338
Hazard Codes
Xi
HS Code
2924297099 · 2924297099

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

hs_code
2924297099
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xi
Hazard statements
H315-H319-H335
Precautionary statements
P261-P305+P351+P338

Chemistry & industry

Upstream & downstream products

Upstream raw materials

1-Bromo-3-iodobenzene3-Bromobenzophenonecarbon monoxideAnilineTriethylamineN,N-Dimethylformamide

Related reactions

1 records
New reaction record
HRID 1600931 reaction equation
HRID 1600931As reactantuspto-grants-1999_11

Compound notes

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